N-(5-chloro-2-methoxyphenyl)-3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
N-(5-chloro-2-methoxyphenyl)-3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide
Compound characteristics
| Compound ID: | D481-0122 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-3-(5-methyl-2-{[(4-methylphenyl)methyl]amino}-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)propanamide |
| Molecular Weight: | 480.95 |
| Molecular Formula: | C24 H25 Cl N6 O3 |
| Smiles: | CC1=C(CCC(Nc2cc(ccc2OC)[Cl])=O)C(n2c(N1)nc(NCc1ccc(C)cc1)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.43 |
| logD: | 3.3868 |
| logSw: | -3.8425 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.702 |
| InChI Key: | ROBFGAQVKATVEA-UHFFFAOYSA-N |