C21H21N3O6 Thimidin, a - [(1-navallenymetil) - a -Oxo- (Aci)
Kasb registr raqami
12620120-90-6
| Asosiy jismoniy xususiyatlar | Qiymati | Shart |
| Molekulyar og'irlik | 411.41 | - |
| Zichlik (bashorat qilingan) | 1.460 ± 0,06 g / sm3 | Temp: 20 ° C; Matbuot: 760 tor |
| PKA (bashorat qilingan) | 8.23 ± 0.10 | Aksariyat kislotali temp: 25 ° C |
Kanronilik tabassum
O = c1nc (= c = c1c ncc2 = cc = cc = ccc = cc32) c4oc (ko) c4
Izomerik tabassumlar
O = c1n (c = c (ncc = c3) c = cc = c3] c (c @ a) (CO) C4 [c4 h] (O) c4
Kelini
Inchi = 1s / c21h21n3o6 / C21-17-16 (26) 8-10-15 (20) 8-10-15 (20) 8-101 (20). 22-9-13-2-7-2-7-14 (12) 13 / H1- 7,10,16,26h, 8-9,111111, (H, 22,27) / T16-, 17 +, 18 + / m0 / s1
Inchi tugmachasi
UudhoszAwhgtb - rccfbdprsa-n
Ushbu modda uchun 3 boshqa ismlar
a - [(1-navalenymetil) Aminokaramidin (ACI); (Napdu); 87: pn: wo2020081510 SEQID: 87 ta da'vo qilingan ketma-ketlik
Xususiyatlar mavjud
Biologik
Kimyoviy
Zichlik
Litski
Tuzilishi bilan bog'liq
| Mulk | Qiymati | Shart | Manba |
| Bioconterstratsion omil | 3.23 | PH 1; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 3.23 | PH 2; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 3.23 | pH 3; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 3.23 | PH 4; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 3.23 | PH 5; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 3.19 | pH 6; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 2.85 | PH 7; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 1.40 | PH 8; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 1.0 | PH 9; Temp: 25 ° C | (1) ACD |
| Bioconterstratsion omil | 1.0 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
| Mulk qiymatining holati manbai |
| KOC 80,5 PH 1; Temp: 25 ° C (1) ACD |
| KOC 80,5 PH 2; Temp: 25 ° C (1) ACD |
| KOC 80,5 pH 3; Temp: 25 ° C (1) ACD |
| KOC 80,5 PH 4; Temp: 25 ° C (1) ACD |
| KOC 80,4 pH 5; Temp: 25 ° C (1) ACD |
| 79,5 pH 6; Temp: 25 ° C (1) ACD |
| 71.1 pH 7; Temp: 25 ° C (1) ACD |
| 34.9 pH 8; Temp: 25 ° C (1) ACD |
| 6.35 pH 9; Temp: 25 ° C (1) ACD |
| 1.39 pH 10; Temp: 25 ° C (1) ACD |
| Logd 0.97 PH 1; Temp: 25 ° C (1) ACD |
| Logd 0.97 PH 2; Temp: 25 ° C (1) ACD |
| Mulk | Qiymati | Shart | Manba |
| logd | 0.97 | pH 3; Temp: 25 ° C | (1) ACD |
| logd | 0.97 | PH 4; Temp: 25 ° C | (1) ACD |
| logd | 0.97 | PH 5; Temp: 25 ° C | (1) ACD |
| logd | 0.97 | pH 6; Temp: 25 ° C | (1) ACD |
| logd | 0,92 | PH 7; Temp: 25 ° C | (1) ACD |
| logd | 0,61 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | -0.13 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | -0.79 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 0.973 ± 0.586 | Temp: 25 ° C | (1) ACD |
| Ommaviy eriylik | 5.3 x 10-3 g / l | Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | pH 3; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | pH 6; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.8 x 10-3 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 0.012 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 0.066 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 0.30 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Ommaviy eruvchanlik | 5.3 x 10-3 g / l | Neytral suv pH 6.37; Temp: 25 ° C | (1) ACD |
| Molyar ichidagi eriylik | 1.3 x 10-5 mol / l | Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.3 x 10-5 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.3 x 10-5 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.3 x 10-5 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.3 x 10-5 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.3 x 10-5 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.3 x 10-5 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.4 x 10-5 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 2.9 x 10-5 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 1.6 x 10-4 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Molyar eriylik | 7.4 x 10-4 MO mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Mulk | Qiymati | Shart | Manba |
| Molyar eriylik | 1.3 x 10-5 mol / l | Neytral suv pH 6.37; Temp: 25 ° C | (1) ACD |
| Molekulyar og'irlik | 411.41 | ||
| pka | 8.23 ± 0.10 | Aksariyat kislotali temp: 25 ° C | (1) ACD |
| pka | -1.90 ± 0.20 | Eng asosiy temp: 25 ° C | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
| Mulk | Qiymati | Shart | Manba |
| Zichlik | 1.460 ± 0,06 g / sm3 | Temp: 20 ° C; Matbuot: 760 tor | (1) ACD |
| Molyar hajmi | 281,6 ± 3.0 sm3 / mol | Temp: 20 ° C; Matbuot: 760 tor | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
| Mulk | Qiymati | Shart | Manba |
| Erkin aylanadigan aloqalar | 7 | (1) ACD | |
| H maqolalari | 9 | (1) ACD | |
| H donorlar | 4 | (1) ACD | |
| H donor / qabul summasi | 13 | (1) ACD | |
| logp | 0.973 ± 0.586 | Temp: 25 ° C | (1) ACD |
| Molekulyar og'irlik | 411.41 |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
| Mulk | Qiymati | Shart manbai |
| Polar sirt maydoni | 128 A2 | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Spektr mavjud
1 h nmr
13 c nmr
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