C20H23N5O6 Adenosasin, N-Benzoyl-2'-O (2-metoksitetil) - (9CI, ACI)
Asosiy jismoniy xususiyatlar | Qiymati | Shart |
Molekulyar og'irlik | 429.43 | - |
Zichlik (bashorat qilingan) | 1.53 ± g / sm3 | Temp: 20 ° C; Matbuot: 760 tor |
PKA (bashorat qilingan) | 13.15 ± 0,70 | Aksariyat kislotali temp: 25 ° C |
Canonik tabassum o = c (NC1 = NC2 = CN2C3OC (CN2C3OC (CN2C3OC (O) C3COCOC) c = 4c = cc4
Izomerik tabassumlar o (c @ h] (o [c @ g] (NC (= O) C4 (= = O) c4 = cn3
Kelini
Indi = 1s / C20H23N5O6 / C129-8-30-15-15 (27) 13-2-23-14-17 (21) 25-11-23-14-14 (14) 25-11 (28) 12-5-2-2-6-12 / H2-6,1 0-11,13,127-27h, 7-9h2,1,1,28,28) / T13-, 20-, 20- S1
Inchi tugmachasi
Rufmcsvngzffb-XTYJDQRSA-N
Ushbu moddaning yana 2 ismi
N-Benzoyl-2-O (2-metoxyetil) Adenosine (ACI); N6-benzoyl-2'-o. (2-metoxyetil) adenozin
Spektr mavjud
1H nmr
NMR nmr
Xususiyatlar mavjud |
Biologik |
Kimyoviy |
Zichlik |
Litski |
Tuzilishi bilan bog'liq |
Biologik
Mulk | Qiymati | Shart | Manba |
Bioconterstratsion omil | 3.71 | PH 1; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 14.6 | PH 2; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 20.9 | pH 3; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 21.8 | PH 4; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 21.9 | PH 5; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 21.8 | pH 6; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 21.4 | PH 7; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 17.6 | PH 8; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 6.52 | PH 9; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1.08 | 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
Kimyoviy
Mulk | Qiymati | Shart | Manba |
Koc | 53.2 | PH 1; Temp: 25 ° C | (1) ACD |
Koc | 210 | PH 2; Temp: 25 ° C | (1) ACD |
Koc | 299 | pH 3; Temp: 25 ° C | (1) ACD |
Koc | 312 | PH 4; Temp: 25 ° C | (1) ACD |
Koc | 314 | PH 5; Temp: 25 ° C | (1) ACD |
Koc | 313 | pH 6; Temp: 25 ° C | (1) ACD |
Koc | 306 | PH 7; Temp: 25 ° C | (1) ACD |
Koc | 253 | PH 8; Temp: 25 ° C | (1) ACD |
Mulk | Qiymati | Shart | Manba |
Koc | 93.5 | PH 9; Temp: 25 ° C | (1) ACD |
Koc | 15,5 | PH 10; Temp: 25 ° C | (1) ACD |
logd | 1.30 | PH 1; Temp: 25 ° C | (1) ACD |
logd | 1.90 | PH 2; Temp: 25 ° C | (1) ACD |
logd | 2.05 | pH 3; Temp: 25 ° C | (1) ACD |
logd | 2.07 | PH 4; Temp: 25 ° C | (1) ACD |
logd | 2.07 | PH 5; Temp: 25 ° C | (1) ACD |
logd | 2.07 | pH 6; Temp: 25 ° C | (1) ACD |
logd | 2.06 | PH 7; Temp: 25 ° C | (1) ACD |
logd | 1.98 | PH 8; Temp: 25 ° C | (1) ACD |
logd | 1.54 | PH 9; Temp: 25 ° C | (1) ACD |
logd | 0,76 | PH 10; Temp: 25 ° C | (1) ACD |
logp | 2.085 ± 0,689 | Temp: 25 ° C | (1) ACD |
Ommaviy eriylik | 0.030 g / l | Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.17 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.0429 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.030 g / l | pH 3; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.029 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.029 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.029 g / l | pH 6; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.029 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.036 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.094 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.60 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 0.029 g / l | Neytral suv pH 6.38; Temp: 25 ° C | (1) ACD |
Molyar ichidagi eriylik | 7.0 x 10-5 mol / l | Temp: 25 ° C | (1) ACD |
Molyar eriylik | 3.9 x 10-4 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.00 x 10-4 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 7.0 x 10-5 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 6.7 x 10-5 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 6.7 x 10-5 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 6.7 x 10-5 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
Mulk | Qiymati | Shart | Manba |
Molyar eriylik | 6.8 x 10-5 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 8.3 x 10-5 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 2.2 x 10-4 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.4 x 10-3 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 6.7 x 10-5 mol / l | Neytral suv pH 6.38; Temp: 25 ° C | (1) ACD |
Molekulyar og'irlik | 429.43 | ||
pka | 13.15 ± 0,70 | Aksariyat kislotali temp: 25 ° C | (1) ACD |
pka | 8.80 ± 0.10 | 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
Zichlik
Mulk | Qiymati | Shart | Manba |
Zichlik | 1.53 ± g / sm3 | Temp: 20 ° C; Matbuot: 760 tor | (1) ACD |
Molyar hajmi | 280.3 ± 7.0 cm3 / 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
Litski
Mulk | Qiymati | Shart | Manba |
Erkin aylanadigan aloqalar | 9 | (1) ACD | |
H maqolalari | 11 | (1) ACD | |
H donorlar | 3 | (1) ACD | |
H donor / qabul summasi | 14 | (1) ACD | |
logp | 2.085 ± 0,689 | Temp: 25 ° C | (1) ACD |
Molekulyar og'irlik | 429.43 |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Tuzilishi bilan bog'liq
Mulk | Qiymati | Shart | Manba |
Polar sirt maydoni | 141 A2 | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Spektr mavjud
1H nmr
NMR nmr