C41H49FN5O8P Sitidin, N-asetil-5' -O- [bis(4-metoksifenil)fenilmetil]-2' - deoksi-2' -ftor-, 3' - [2-siyanoetil N,N-bis(1-metiletil) fosfor amidit] (ACI)

mahsulot

C41H49FN5O8P Sitidin, N-asetil-5' -O- [bis(4-metoksifenil)fenilmetil]-2' - deoksi-2' -ftor-, 3' - [2-siyanoetil N,N-bis(1-metiletil) fosfor amidit] (ACI)

Asosiy ma'lumotlar:


Mahsulot detali

Mahsulot teglari

Modda tafsilotlari

CAS ro'yxatga olish raqami

159414-99-0

Asosiy jismoniy xususiyatlar Qiymat Vaziyat
Molekulyar og'irlik 789,83 -
pKa (taxmin qilingan) 10,11±0,20 Eng kislotali harorat: 25 °C

 

Boshqa ismlar va identifikatorlar

Kanonik tabassum

N#CCCOP(OC1C(F)C(OC1COC(C=2C=CC=CC2)(C3=CC=C(OC)C=C3)C4=CC=C(OC)C=C4)N5C=CC(= NC5=O)NC(=O)C)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](F)[C@@ H](O1)N2C(=O)N=C(NC(C)=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC=C (OC)C=C4 )C5=CC=CC=C5

InChI

InChI= 1S/C41H49FN5O8P/c1-27(2)47(28(3)4)56(53-25-11-23-43)55-38-35(54-39(37(38)42)46- 24-22-36(44-29(5)48)45-40(46)49)26-52- 41(30-12-9-8-10-13-30,31-14-18-33( 50-6)19-15-31)32-16-20-34(51-7)21-17-32/h8-10,12-22,24,27-28,35,37-39H,11, 25-26H2,1-7H3,(H, 44,45,48,49)/t35-,37-,38-,39-,56?/m1/s1

InChI kaliti

CNFKJHKDSRXNFL-UTXREMQHSA-N

1 Ushbu moddaning boshqa nomi

sitidin,N-asetil-5' -O- [bis(4-metoksifenil)fenilmetil]-2' -deoksi-2' -ftor-, 3' - [2-siyanoetil bis(1-metiletil)fosfor amidit] (9CI)
Spektrlar mavjud
Massa

Bashorat qilingan xususiyatlar

Xususiyatlari mavjud
Biologik
Kimyoviy
Lipinskiy
Tuzilishi bilan bog'liq

Biologik

Mulk Qiymat Vaziyat Manba
Biokonsentratsiya omili 8.60 pH 1; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 90.3 pH 2; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 3940 pH 3; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 39100 pH 4; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 64300 pH 5; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 68100 pH 6; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 68300 pH 7; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 66800 pH 8; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 54300 pH 9; Harorat: 25 °C (1) ACD
Biokonsentratsiya omili 19200 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)

Kimyoviy

Mulk Qiymat Vaziyat Manba
Koch 12.6 pH 1; Harorat: 25 °C (1) ACD
Koch 133 pH 2; Harorat: 25 °C (1) ACD
Koch 5790 pH 3; Harorat: 25 °C (1) ACD
Koch 57400 pH 4; Harorat: 25 °C (1) ACD
Koch 94500 pH 5; Harorat: 25 °C (1) ACD
Koch 1,00 x 105 pH 6; Harorat: 25 °C (1) ACD
Koch 1,00 x 105 pH 7; Harorat: 25 °C (1) ACD
Koch 98200 pH 8; Harorat: 25 °C (1) ACD
Koch 79700 pH 9; Harorat: 25 °C (1) ACD
Koch 28200 pH 10; Harorat: 25 °C (1) ACD

 

Mulk Qiymat Vaziyat Manba
logD 2.76 pH 1; Harorat: 25 °C (1) ACD
logD 3.79 pH 2; Harorat: 25 °C (1) ACD
logD 5.43 pH 3; Harorat: 25 °C (1) ACD
logD 6.42 pH 4; Harorat: 25 °C (1) ACD
logD 6.64 pH 5; Harorat: 25 °C (1) ACD
logD 6.66 pH 6; Harorat: 25 °C (1) ACD
logD 6.66 pH 7; Harorat: 25 °C (1) ACD
logD 6.65 pH 8; Harorat: 25 °C (1) ACD
logD 6.56 pH 9; Harorat: 25 °C (1) ACD
logD 6.11 pH 10; Harorat: 25 °C (1) ACD
logP 6,666±0,764 Harorat: 25 °C (1) ACD
Massaning ichki eruvchanligi 4,5 x 10-5 g/l Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 0,36 g/l pH 1; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 0,035 g/l pH 2; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 7,90 x 10-4 g/L pH 3; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 7,9 x 10-5 g/l pH 4; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 4,8 x 10-5 g/l pH 5; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 4,6 x 10-5 g/l pH 6; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 4,6 x 10-5 g/l pH 7; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 4,7 x 10-5 g/L pH 8; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 5,7 x 10-5 g/l pH 9; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 1,6 x 10-4 g/l pH 10; Harorat: 25 °C (1) ACD
Ommaviy eruvchanlik 4,6 x 10-5 g/l Bufersiz suv pH 7.00; Harorat: 25 °C (1) ACD
Molar ichki eruvchanligi 5,7 x 10-8 mol/L Harorat: 25 °C (1) ACD
Molyar eruvchanlik 4,6 x 10-4 mol/L pH 1; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 4,4 x 10-5 mol/l pH 2; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 1,00 x 10-6 mol/L pH 3; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 1,0 x 10-7 mol/L pH 4; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 6,1 x 10-8 mol/L pH 5; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 5,8 x 10-8 mol/L pH 6; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 5,8 x 10-8 mol/L pH 7; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 5,9 x 10-8 mol/L pH 8; Harorat: 25 °C (1) ACD

 

Mulk Qiymat Vaziyat Manba
Molyar eruvchanlik 7,2 x 10-8 mol/L pH 9; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 2,0 x 10-7 mol/L pH 10; Harorat: 25 °C (1) ACD
Molyar eruvchanlik 5,8 x 10-8 mol/L Bufersiz suv pH 7.00; Harorat: 25 °C (1) ACD
Molekulyar og'irlik 789,83
pKa 10,11±0,20 Eng kislotali harorat: 25 °C (1) ACD
pKa 3,57±0,20 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)

Tuzilishi bilan bog'liq

Mulk Qiymat Vaziyat manbai
Qutb yuzasi maydoni 158 A2 (1) ACD

(1) Ilg'or kimyoni ishlab chiqish (ACD/Labs) V11.02 dasturiy ta'minoti yordamida hisoblangan (© 1994-2023 ACD/Labs)


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