N-(4-bromophenyl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide
N-(4-bromophenyl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide
Compound characteristics
| Compound ID: | D458-0632 |
| Compound Name: | N-(4-bromophenyl)-2-(2-cyclohexyl-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)acetamide |
| Molecular Weight: | 442.36 |
| Molecular Formula: | C21 H24 Br N5 O |
| Smiles: | Cc1c(CC(Nc2ccc(cc2)[Br])=O)c(C)n2c(n1)nc(C1CCCCC1)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.6608 |
| logD: | 4.6599 |
| logSw: | -4.3957 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.174 |
| InChI Key: | QLUWTQJITPZBJM-UHFFFAOYSA-N |