C43H55N4O10P Uridin, 5′ -O- [bis(4-metoksifenil)fenilmetil]-2′ -O-(2-metoks yetil)- 5-metil-, 3′ – [2-siyanoetil N,N-bis(1-) metiletil)fosfor amidit] (ACI)
CAS ro'yxatga olish raqami
163878-63-5
H302
Asosiy jismoniy xususiyatlar | Qiymat | Vaziyat |
Molekulyar og'irlik | 818.89 | - |
pKa (taxmin qilingan) | 9,55±0,10 | Eng kislotali harorat: 25 °C |
Kanonik tabassum
N#CCCOP(OC1C(OC(N2C=C(C(=O)NC2=O)C)C1OCCOC)COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5= CC=C(OC)C=C5)N(C(C)C)C(C)C
Izomerik tabassum
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@ H](O1)N2C(=O)NC(=O)C(C)=C2)(C3=CC=C(OC)C=C3)(C4=CC =C(OC)C=C4)C5= CC=CC=C5
InChI
InChI= 1S/C43H55N4O10P/c1-29(2)47(30(3)4)58(55-24-12-23-44)57-38-37(56-41(39(38)53-26- 25-50-6)46-27-31(5)40(48)45-42(46)49)2 8-54-43(32-13-10-9-11-14-32,33-15 -19-35(51-7)20-16-33)34-17-21-36(52-8)22-18-34/h9-11,13-22,27,29-30,37-39 ,41H,12,24-26,28H2, 1-8H3,(H,45,48,49)/t37-,38-,39-,41-,58?/m1/s1
InChI kaliti
YFRRKZDUDXHJNC-KZQAAKLLSA-N
17 Ushbu moddaning boshqa nomlari
Uridin, 5′ -O- [bis(4-metoksifenil)fenilmetil]-2' -O-(2-metoksietil)- 5-metil-, 3' - [2-siyanoetil bis(1-metiletil)fosfor
amidit] (9CI); 10: PN: US20030212017 PAGE: 18 da'vo qilingan RNK; 11: PN: US20030211606 PAGE: 18 da'vo qilingan RNK; 13: PN: US20040
005569 PAGE: 21 da'vo qilingan RNK; 13: PN: US20040006030 PAGE: 22 da'vo qilingan RNK; 13: PN: US20040014048 PAGE: 19 da'vo qilingan RNK; 13: PN: US20040014049 PAGE: 19 da'vo qilingan RNK; 14: PN: US20030198965 PAGE: 19 da'vo qilingan RNK; 14: PN: US20040005565 PAGE: 17- 22 da'vo qilingan RNK; 14: PN: US20040005570 PAGE: 19 da'vo qilingan RNK; 14: PN: US20040014047 PAGE: 19 da'vo qilingan RNK; 14: PN: US20040
014699 PAGE: 19 da'vo qilingan RNK; 15: PN: US20040014050 PAGE: 19 da'vo qilingan RNK; 15: PN: US20040014051 PAGE: 21 da'vo qilingan RNK; 15:
PN: WO03106645 PAGE: 69 da'vo qilingan RNK; 16: PN: US20040006029 PAGE: 22 da'vo qilingan RNK; 87: PN: US20040005707 PAGE: 19 da'vo qilingan RNK
Spektrlar mavjud
1H NMR
13C NMR
Hetero NMR
Xususiyatlari mavjud
Biologik
Kimyoviy
Lipinskiy
Tuzilishi bilan bog'liq
Mulk | Qiymat | Vaziyat | Manba |
Biokonsentratsiya omili | 348 | pH 1; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 2810 | pH 2; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 21100 | pH 3; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 63100 | pH 4; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 78800 | pH 5; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 80800 | pH 6; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 80800 | pH 7; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 78800 | pH 8; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 63400 | pH 9; Harorat: 25 °C | (1) ACD |
Biokonsentratsiya omili | 21800 | pH 10; Harorat: 25 °C | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat | Manba |
Koch | 487 | pH 1; Harorat: 25 °C | (1) ACD |
Koch | 3940 | pH 2; Harorat: 25 °C | (1) ACD |
Koch | 29600 | pH 3; Harorat: 25 °C | (1) ACD |
Koch | 88400 | pH 4; Harorat: 25 °C | (1) ACD |
Mulk | Qiymat | Vaziyat | Manba |
Koch | 1,10 x 105 | pH 5; Harorat: 25 °C | (1) ACD |
Koch | 1,13 x 105 | pH 6; Harorat: 25 °C | (1) ACD |
Koch | 1,13 x 105 | pH 7; Harorat: 25 °C | (1) ACD |
Koch | 1,10 x 105 | pH 8; Harorat: 25 °C | (1) ACD |
Koch | 88800 | pH 9; Harorat: 25 °C | (1) ACD |
Koch | 30600 | pH 10; Harorat: 25 °C | (1) ACD |
logD | 4.39 | pH 1; Harorat: 25 °C | (1) ACD |
logD | 5.30 | pH 2; Harorat: 25 °C | (1) ACD |
logD | 6.18 | pH 3; Harorat: 25 °C | (1) ACD |
logD | 6.65 | pH 4; Harorat: 25 °C | (1) ACD |
logD | 6.75 | pH 5; Harorat: 25 °C | (1) ACD |
logD | 6.76 | pH 6; Harorat: 25 °C | (1) ACD |
logD | 6.76 | pH 7; Harorat: 25 °C | (1) ACD |
logD | 6.75 | pH 8; Harorat: 25 °C | (1) ACD |
logD | 6.65 | pH 9; Harorat: 25 °C | (1) ACD |
logD | 6.19 | pH 10; Harorat: 25 °C | (1) ACD |
logP | 6,761±0,669 | Harorat: 25 °C | (1) ACD |
Massaning ichki eruvchanligi | 2,0 x 10-4 g/L | Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 0,046 g/l | pH 1; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 5,7 x 10-3 g/l | pH 2; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 7,6 x 10-4 g/l | pH 3; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,5 x 10-4 g/l | pH 4; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,0 x 10-4 g/L | pH 5; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,0 x 10-4 g/L | pH 6; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,0 x 10-4 g/L | pH 7; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,0 x 10-4 g/L | pH 8; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,5 x 10-4 g/l | pH 9; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 7,4 x 10-4 g/l | pH 10; Harorat: 25 °C | (1) ACD |
Ommaviy eruvchanlik | 2,0 x 10-4 g/L | Bufersiz suv pH 7.00; Harorat: 25 °C | (1) ACD |
Molar ichki eruvchanligi | 2,4 x 10-7 mol/L | Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 5,6 x 10-5 mol/L | pH 1; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 7,0 x 10-6 mol/L | pH 2; Harorat: 25 °C | (1) ACD |
Mulk | Qiymat | Vaziyat | Manba |
Molyar eruvchanlik | 9,3 x 10-7 mol/L | pH 3; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 3,1 x 10-7 mol/L | pH 4; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 2,5 x 10-7 mol/l | pH 5; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 2,4 x 10-7 mol/L | pH 6; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 2,4 x 10-7 mol/L | pH 7; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 2,5 x 10-7 mol/l | pH 8; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 3,1 x 10-7 mol/L | pH 9; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 9,0 x 10-7 mol/L | pH 10; Harorat: 25 °C | (1) ACD |
Molyar eruvchanlik | 2,4 x 10-7 mol/L | Bufersiz suv pH 7.00; Harorat: 25 °C | (1) ACD |
Molekulyar og'irlik | 818.89 | ||
pKa | 9,55±0,10 | Eng kislotali harorat: 25 °C | (1) ACD |
pKa | 3,45±0,70 | Eng asosiy harorat: 25 °C | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat | Manba |
Erkin aylanadigan obligatsiyalar | 21 | (1) ACD | |
H qabul qiluvchilar | 14 | (1) ACD | |
H Donorlar | 1 | (1) ACD | |
H Donor/akseptor summasi | 15 | (1) ACD | |
logP | 6,761±0,669 | Harorat: 25 °C | (1) ACD |
Molekulyar og'irlik | 818.89 |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Mulk | Qiymat | Vaziyat manbai |
Qutb yuzasi maydoni | 164 A2 | (1) ACD |
(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)
Spektrlar mavjud
1H NMR
13C NMR
Kod xavf bayonoti manbasi | |
H302 Yutilganda zararli | Evropa kimyo agentligi (ECHA) tasniflash va etiketlash Inventarizatsiya - Xabar qilingan tasnif va etiketka - eng keng tarqalgan bildirishnomalar, Evropa kimyo agentligi (ECHA) Tasniflash va etiketkalash inventarizatsiyasi - Xabardor qilingan tasnif va etiketkalar - eng jiddiy bildirishnomalar |