4-tert-butyl-N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide
Chemical Structure Depiction of
4-tert-butyl-N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide
4-tert-butyl-N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide
Compound characteristics
| Compound ID: | D433-0682 |
| Compound Name: | 4-tert-butyl-N-[(6-chloro-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide |
| Molecular Weight: | 447.97 |
| Molecular Formula: | C25 H26 Cl N5 O |
| Smiles: | Cc1c(c(C)n2c(n1)nc(CN(C(c1ccc(cc1)C(C)(C)C)=O)c1ccccc1)n2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3833 |
| logD: | 5.3833 |
| logSw: | -5.8118 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.718 |
| InChI Key: | RBJODMBKNPAVSI-UHFFFAOYSA-N |