![C21H21N3O6 Timidin, a – [(1-naftalenilmetil)amino]- a -okso- (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C21H21N3O6 Timidin, a – [(1-naftalenilmetil)amino]- a -okso- (ACI) Tavsiya etilgan rasm](https://www.csnvchem.com/uploads/C21H21N3O6-Thymidine.png)
C21H21N3O6 Timidin, a – [(1-naftalenilmetil)amino]- a -okso- (ACI)
CAS ro'yxatga olish raqami
1262015-90-6
| Asosiy jismoniy xususiyatlar | Qiymat | Vaziyat |
| Molekulyar og'irlik | 411.41 | - |
| Zichlik (taxmin qilingan) | 1,460±0,06 g/sm3 | Harorat: 20 °C;Matbuot: 760 Torr |
| pKa (taxmin qilingan) | 8,23±0,10 | Eng kislotali harorat: 25 °C |
Kanonik tabassum
O=C1NC(=O)N(C=C1C(=O)NCC2=CC=CC=3C=CC=CC32)C4OC(CO)C(O)C4
Izomerik tabassum
O=C1N(C=C(C(NCC=2C3=C(C=CC2)C=CC=C3)=O)C(=O)N1)[C@@H]4O[C@H](CO )[C@@H](O)C4
InChI
InChI= 1S/C21H21N3O6/c25-11-17-16(26)8-18(30-17)24-10-15(20(28)23-21(24)29)19(27)22-9- 13-6-3-5-12-4-1-2-7-14(12)13/h1- 7,10,16-18,25-26H,8-9,11H2,(H,22,27) )(H,23,28,29)/t16-,17+,18+/m0/s1
InChI kaliti
UUDHOSZAWIHGTB-RCCFBDPRSA-N
3 Ushbu moddaning boshqa nomlari
a -[(1-Naftalenilmetil)amino]- a -oksotimidin (ACI);(NapdU);87: PN: WO2020081510 SEQID: 87 da'vo qilingan ketma-ketlik
Xususiyatlari mavjud
Biologik
Kimyoviy
Zichlik
Lipinskiy
Tuzilishi bilan bog'liq
| Mulk | Qiymat | Vaziyat | Manba |
| Biokonsentratsiya omili | 3.23 | pH 1;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 3.23 | pH 2;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 3.23 | pH 3;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 3.23 | pH 4;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 3.23 | pH 5;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 3.19 | pH 6;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 2.85 | pH 7;Harorat: 25 °C | (1) ACD |
| Biokonsentratsiya omili | 1.40 | 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 80,5 pH 1;Harorat: 25 °C (1) ACD |
| Koc 80,5 pH 2;Harorat: 25 °C (1) ACD |
| Koc 80,5 pH 3;Harorat: 25 °C (1) ACD |
| Koc 80,5 pH 4;Harorat: 25 °C (1) ACD |
| Koc 80,4 pH 5;Harorat: 25 °C (1) ACD |
| Koc 79,5 pH 6;Harorat: 25 °C (1) ACD |
| Koc 71,1 pH 7;Harorat: 25 °C (1) ACD |
| Koc 34,9 pH 8;Harorat: 25 °C (1) ACD |
| Koc 6,35 pH 9;Harorat: 25 °C (1) ACD |
| Koc 1,39 pH 10;Harorat: 25 °C (1) ACD |
| logD 0,97 pH 1;Harorat: 25 °C (1) ACD |
| logD 0,97 pH 2;Harorat: 25 °C (1) ACD |
| Mulk | Qiymat | Vaziyat | Manba |
| logD | 0,97 | pH 3;Harorat: 25 °C | (1) ACD |
| logD | 0,97 | pH 4;Harorat: 25 °C | (1) ACD |
| logD | 0,97 | pH 5;Harorat: 25 °C | (1) ACD |
| logD | 0,97 | pH 6;Harorat: 25 °C | (1) ACD |
| logD | 0,92 | pH 7;Harorat: 25 °C | (1) ACD |
| logD | 0,61 | pH 8;Harorat: 25 °C | (1) ACD |
| logD | -0,13 | pH 9;Harorat: 25 °C | (1) ACD |
| logD | -0,79 | pH 10;Harorat: 25 °C | (1) ACD |
| logP | 0,973±0,586 | Harorat: 25 °C | (1) ACD |
| Massaning ichki eruvchanligi | 5,3 x 10-3 g/L | Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | pH 1;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | pH 2;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | pH 3;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | pH 4;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | pH 5;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | pH 6;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,8 x 10-3 g/l | pH 7;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,012 g/l | pH 8;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,066 g/l | pH 9;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 0,30 g/l | pH 10;Harorat: 25 °C | (1) ACD |
| Ommaviy eruvchanlik | 5,3 x 10-3 g/L | Bufersiz suv pH 6,37;Harorat: 25 °C | (1) ACD |
| Molar ichki eruvchanligi | 1,3 x 10-5 mol/l | Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | pH 1;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | pH 2;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | pH 3;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | pH 4;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | pH 5;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | pH 6;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,4 x 10-5 mol/L | pH 7;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 2,9 x 10-5 mol/L | pH 8;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 1,6 x 10-4 mol/L | pH 9;Harorat: 25 °C | (1) ACD |
| Molyar eruvchanlik | 7,4 x 10-4 mol/L | pH 10;Harorat: 25 °C | (1) ACD |
| Mulk | Qiymat | Vaziyat | Manba |
| Molyar eruvchanlik | 1,3 x 10-5 mol/l | Bufersiz suv pH 6,37;Harorat: 25 °C | (1) ACD |
| Molekulyar og'irlik | 411.41 | ||
| pKa | 8,23±0,10 | Eng kislotali harorat: 25 °C | (1) ACD |
| pKa | -1,90±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 | 1,460±0,06 g/sm3 | Harorat: 20 °C;Matbuot: 760 Torr | (1) ACD |
| Molyar hajm | 281,6±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 | 0,973±0,586 | Harorat: 25 °C | (1) ACD |
| Molekulyar og'irlik | 411.41 |
(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
![C17H19N3O6 Timidin, a -okso- a -[(fenilmetil)amino]- (ACI)](https://www.csnvchem.com/uploads/C17H19N3O6-Thymidine-300x300.png)