N-(4-bromo-3-methylphenyl)-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
N-(4-bromo-3-methylphenyl)-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M447-0340 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-[8-(dimethylamino)-3-oxo[1,3]thiazolo[5,4-e][1,2,4]triazolo[4,3-c]pyrimidin-2(3H)-yl]acetamide |
| Molecular Weight: | 462.33 |
| Molecular Formula: | C17 H16 Br N7 O2 S |
| Smiles: | Cc1cc(ccc1[Br])NC(CN1C(N2C=Nc3c(C2=N1)sc(n3)N(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2024 |
| logD: | 3.201 |
| logSw: | -3.1989 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.038 |
| InChI Key: | JQDDCRBHZLOYPS-UHFFFAOYSA-N |