C30h28n2o7 6h-furo [2 ', 3': 4,5] Pirimidin-6 --2,3,3a, 9a-tetrarro-3-gidroksi-, (2r, 3r, 3r, 3as, 9AR) - (9Ci, Aci)
Asosiy jismoniy xususiyatlar | Qiymati | Shart |
Molekulyar og'irlik | 528.55 | - |
Erish nuqtasi (tajriba) | 129.5-130 ° C | - |
Qaynab turgan nuqta (bashorat qilingan) | 688.2 ± 65,0 ° C | Matbuot: 760 tor |
Zichlik (bashorat qilingan) | 1.35 ± 0 g / sm3 | Temp: 20 ° C; Matbuot: 760 tor |
PKA (bashorat qilingan) | 12.51 ± 0,40 | Aksariyat kislotali temp: 25 ° C |
Canonik tabassum o = c1n = c2oc3c (OC3N2C = C1) COC (C5 = CC = C1) c6 = CC = C (OC) C = C6
Izemerik tabassum c (OC [C @@ @@ @@ @@ @@) = cc (C5 = CC = C4) c6 = CC = CC = CC
Kelini
Indi = 1s / c30h28n2o7 / C1-3-22-12-8-8-7,21-2-7,21-7,21-2-7,21-7,22-7,21-2-7,21-2-7,21-22 gacha (36-2-5-14,2-2-22) 30 (36-2-5-7,22-2-21) 37-11-21) 37-11-24, 27-28 16-25 (33) 31-29 (32-27 / H3-17,24,28,38,28,34-28,28,28,28,34-24-, 26-, 26- S1)
Inchi tugmachasi
Oeirlwcmaicdww-aogflwsa-n
Ushbu moddaning yana 2 ismi
(2R, 3r, 3as, 9AR) - [BIS (4-metvopenil) fenilmetxy] - okazolo [3,2-a] pirimidin-6-6-biri (ACI); 6h-furo [2 ', 3': 4,5] Okzidin-6-son, 2 - [BIS (4-metvokxenil) fenilmetxy] -2,3a, 9A-
Tetrradro-3-gidroksi-, [2r- 3, 3Ax, 9a, 9ax 9AB)] - (ZCI)
Xususiyatlar mavjud |
Issiqlik |
Issiqlik
Mulk | Qiymati | Shart | Manba |
Erish nuqtasi | 129.5-130 ° C | (1) Cas |
(1) plenksioner, maqol; Nukleosidlar, nukleotidlar va nuklein kislotalar, (2016), 35 (8), 410-425, Kaplus
Spektr mavjud |
1H nmr |
NMR nmr |
IR |
Massa |
Bashorat qilingan xususiyatlar
Xususiyatlar mavjud |
Biologik |
Kimyoviy |
Zichlik |
Litski |
Tuzilishi bilan bog'liq |
Issiqlik |
Biologik
Mulk | Qiymati | Shart | Manba |
Bioconterstratsion omil | 1360 yilda | PH 1; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | PH 2; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | pH 3; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | PH 4; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | PH 5; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | pH 6; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | PH 7; Temp: 25 ° C | (1) ACD |
Mulk | Qiymati | Shart | Manba |
Bioconterstratsion omil | 1360 yilda | PH 8; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1360 yilda | PH 9; Temp: 25 ° C | (1) ACD |
Bioconterstratsion omil | 1350 | 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 | 6080 | PH 1; Temp: 25 ° C | (1) ACD |
Koc | 6080 | PH 2; Temp: 25 ° C | (1) ACD |
Koc | 6080 | pH 3; Temp: 25 ° C | (1) ACD |
Koc | 6080 | PH 4; Temp: 25 ° C | (1) ACD |
Koc | 6080 | PH 5; Temp: 25 ° C | (1) ACD |
Koc | 6080 | pH 6; Temp: 25 ° C | (1) ACD |
Koc | 6080 | PH 7; Temp: 25 ° C | (1) ACD |
Koc | 6080 | PH 8; Temp: 25 ° C | (1) ACD |
Koc | 6070 | PH 9; Temp: 25 ° C | (1) ACD |
Koc | 6060 | PH 10; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 1; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 2; Temp: 25 ° C | (1) ACD |
logd | 4.42 | pH 3; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 4; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 5; Temp: 25 ° C | (1) ACD |
logd | 4.42 | pH 6; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 7; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 8; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 9; Temp: 25 ° C | (1) ACD |
logd | 4.42 | PH 10; Temp: 25 ° C | (1) ACD |
logp | 4.424 ± 0.618 | Temp: 25 ° C | (1) ACD |
Ommaviy eriylik | 5.8 x 10-4 g / l | Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | pH 3; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Mulk | Qiymati | Shart | Manba |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | pH 6; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Ommaviy eruvchanlik | 5.8 x 10-4 g / l | Neytral suv pH 7.00; Temp: 25 ° C | (1) ACD |
Molyar ichidagi eriylik | 1.1 x 10-6 mol / l | Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | pH 3; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | pH 6; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Molyar eriylik | 1.1 x 10-6 mol / l | Neytral suv pH 7.00; Temp: 25 ° C | (1) ACD |
Molekulyar og'irlik | 528.55 | ||
pka | 12.51 ± 0,40 | Aksariyat kislotali temp: 25 ° C | (1) ACD |
pka | -4.70 ± 0,60 | Eng asosiy temp: 25 ° C | (1) ACD |
Bug 'bosimi | 6.91 x 10-20 tor | 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 | 1.35 ± 0 g / sm3 | Temp: 20 ° C; Matbuot: 760 tor | (1) ACD |
Molyar hajmi | 389.8 ± 7.0 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
Litski
Mulk | Qiymati | Shart | Manba |
Erkin aylanadigan aloqalar | 9 | (1) ACD | |
Mulk | Qiymati | Shart | Manba |
H maqolalari | 9 | (1) ACD | |
H donorlar | 1 | (1) ACD | |
H donor / qabul summasi | 10 | (1) ACD | |
logp | 4.424 ± 0.618 | Temp: 25 ° C | (1) ACD |
Molekulyar og'irlik | 528.55 |
(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 | 99.1 A2 | (1) ACD |
(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan
Issiqlik
Mulk | Qiymati | Shart | Manba |
Qaynab turgan nuqta | 688.2 ± 65,0 ° C | Matbuot: 760 tor | (1) ACD |
Bug'lanishning boshi | 105.96 ± 3.0 kj / mol | Matbuot: 760 tor | (1) ACD |
O't olish nuqtasi | 370,0 ± 34,3 ° C | (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