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![C17H19N3O6 Timidin, a -okso- a -[(fenilmetil)amino]- (ACI) Tavsiya etilgan rasm](https://www.csnvchem.com/uploads/C17H19N3O6-Thymidine.png)
C17H19N3O6 Timidin, a -okso- a -[(fenilmetil)amino]- (ACI)
CAS ro'yxatga olish raqami
944268-75-1
| Asosiy jismoniy xususiyatlar | Qiymat | Vaziyat |
| Molekulyar og'irlik | 361.35 | - |
| Zichlik (taxmin qilingan) | 1,459±0,06 g/sm3 | Harorat: 20 °C; Matbuot: 760 Torr |
| pKa (taxmin qilingan) | 8,27±0,10 | Eng kislotali harorat: 25 °C |
Kanonik tabassum
O=C1NC(=O)N(C=C1C(=O)NCC=2C=CC=CC2)C3OC(CO)C(O)C3
Izomerik tabassum
O=C1N([C@@H]2O[C@H](CO)[C@@H](O)C2)C=C(C(NCC3=CC=CC=C3)=O)C(= O) N1
InChI
InChI= 1S/C17H19N3O6/c21-9-13-12(22)6-14(26-13)20-8-11(16(24)19-17 (20)25)15(23)18-7-10-4-2-1-3-5-10/h1-5,8,12-14,21-22H,6-7,9 H2,(H,18,23)(H,19,24,25)/t12-,13+,14+/m0/s1
InChI kaliti
VBRYAGCUEXFMKM-BFHYXJOUSA-N
3 Ushbu moddaning boshqa nomlari
a -Oxo-a -[(fenilmetil)amino]timidin (ACI); (BndU); 7: PN: WO2020081510 SEQID: 7 da'vo qilingan ketma-ketlik
Xususiyatlari mavjud
Biologik
Kimyoviy
Zichlik
Lipinskiy
Tuzilishi bilan bog'liq
| Mulk | Qiymat | Vaziyat | Manba |
| Biokonsentratsiya omili | 1.0 | pH 1; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 2; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 3; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 4; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 5; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 6; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 7; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 8; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | pH 9; Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.0 | 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 qiymati Vaziyat Manba |
| Koc 18,3 pH 1; Harorat: 25 °C (1) ACD |
| Koc 18,3 pH 2; Harorat: 25 °C (1) ACD |
| Koc 18,3 pH 3; Harorat: 25 °C (1) ACD |
| Koc 18,3 pH 4; Harorat: 25 °C (1) ACD |
| Koc 18,3 pH 5; Harorat: 25 °C (1) ACD |
| Koc 18,1 pH 6; Harorat: 25 °C (1) ACD |
| Koc 16,4 pH 7; Harorat: 25 °C (1) ACD |
| Koc 8,56 pH 8; Harorat: 25 °C (1) ACD |
| Koc 1,62 pH 9; Harorat: 25 °C (1) ACD |
| Koc 1,0 pH 10; Harorat: 25 °C (1) ACD |
| logD -0,21 pH 1; Harorat: 25 °C (1) ACD |
| logD -0,21 pH 2; Harorat: 25 °C (1) ACD |
| Mulk | Qiymat | Vaziyat | Manba |
| logD | -0,21 | pH 3; Harorat: 25 °C | (1) ACD |
| logD | -0,21 | pH 4; Harorat: 25 °C | (1) ACD |
| logD | -0,21 | pH 5; Harorat: 25 °C | (1) ACD |
| logD | -0,22 | pH 6; Harorat: 25 °C | (1) ACD |
| logD | -0,26 | pH 7; Harorat: 25 °C | (1) ACD |
| logD | -0,54 | pH 8; Harorat: 25 °C | (1) ACD |
| logD | -1,26 | pH 9; Harorat: 25 °C | (1) ACD |
| logD | -1,95 | pH 10; Harorat: 25 °C | (1) ACD |
| logP | -0,212±0,585 | Harorat: 25 °C | (1) ACD |
| Massaning ichki eruvchanligi | 0,13 g/l | Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,13 g/l | pH 1; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,13 g/l | pH 2; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,13 g/l | pH 3; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,13 g/l | pH 4; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,13 g/l | pH 5; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,14 g/l | pH 6; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,15 g/l | pH 7; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,29 g/l | pH 8; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 1,5 g/l | pH 9; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 7,2 g/l | pH 10; Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,14 g/l | Bufersiz suv pH 5,68; Harorat: 25 °C | (1) ACD |
| Molar ichki eruvchanligi | 3,7 x 10-4 mol/L | Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 3,7 x 10-4 mol/L | pH 1; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 3,7 x 10-4 mol/L | pH 2; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 3,7 x 10-4 mol/L | pH 3; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 3,7 x 10-4 mol/L | pH 4; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 3,7 x 10-4 mol/L | pH 5; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 3,8 x 10-4 mol/L | pH 6; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 4,2 x 10-4 mol/L | pH 7; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 8,0 x 10-4 mol/L | pH 8; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 4,2 x 10-3 mol/L | pH 9; Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 0,020 mol/l | pH 10; Harorat: 25 °C | (1) ACD |
| Mulk | Qiymat | Vaziyat | Manba |
| Molyar eruvchanlik | 3,8 x 10-4 mol/L | Bufersiz suv pH 5,68; Harorat: 25 °C | (1) ACD |
| Molekulyar og'irlik | 361.35 | ||
| pKa | 8,27±0,10 | Eng kislotali harorat: 25 °C | (1) ACD |
| pKa | -1,66±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)
| Mulk | Qiymat | Vaziyat | Manba |
| Zichlik | 1,459±0,06 g/sm3 | Harorat: 20 °C; Matbuot: 760 Torr | (1) ACD |
| Molyar hajm | 247,5±3,0 sm3/mol | Harorat: 20 °C; Matbuot: 760 Torr | (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 | 7 | (1) ACD | |
| H qabul qiluvchilar | 9 | (1) ACD | |
| H Donorlar | 4 | (1) ACD | |
| H Donor/akseptor summasi | 13 | (1) ACD | |
| logP | -0,212±0,585 | Harorat: 25 °C | (1) ACD |
| Molekulyar og'irlik | 361.35 |
(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 | 128 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
![C21H21N3O6 Timidin, a – [(1-naftalenilmetil)amino]- a -okso- (ACI)](https://www.csnvchem.com/uploads/C21H21N3O6-Thymidine-300x300.png)
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