3-(2-{[(4-chlorophenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(2,4-dimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-(2-{[(4-chlorophenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(2,4-dimethoxyphenyl)propanamide
3-(2-{[(4-chlorophenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(2,4-dimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | D481-0083 |
| Compound Name: | 3-(2-{[(4-chlorophenyl)methyl]amino}-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-N-(2,4-dimethoxyphenyl)propanamide |
| Molecular Weight: | 496.95 |
| Molecular Formula: | C24 H25 Cl N6 O4 |
| Smiles: | CC1=C(CCC(Nc2ccc(cc2OC)OC)=O)C(n2c(N1)nc(NCc1ccc(cc1)[Cl])n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0937 |
| logD: | 3.0505 |
| logSw: | -3.6253 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.246 |
| InChI Key: | UXZMYXAZXPQWDZ-UHFFFAOYSA-N |