N-(3-chloro-2-methylphenyl)-5-oxo-2-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-5-oxo-2-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
N-(3-chloro-2-methylphenyl)-5-oxo-2-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
Compound characteristics
| Compound ID: | D718-0485 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-5-oxo-2-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide |
| Molecular Weight: | 381.82 |
| Molecular Formula: | C19 H16 Cl N5 O2 |
| Smiles: | Cc1c(cccc1[Cl])NC(C1CC(Nc2nc(c3ccccc3)nn12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.398 |
| logD: | 3.3975 |
| logSw: | -3.8251 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.704 |
| InChI Key: | VYLCFPXGXZFEBH-HNNXBMFYSA-N |