N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-chlorophenyl)methyl]acetamide
Chemical Structure Depiction of
N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-chlorophenyl)methyl]acetamide
N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-chlorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | D524-2853 |
| Compound Name: | N-(6-butyl-5-methyl-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-[(4-chlorophenyl)methyl]acetamide |
| Molecular Weight: | 387.87 |
| Molecular Formula: | C19 H22 Cl N5 O2 |
| Smiles: | [H]C([H])(CCC)C1=C(C)Nc2nc(nn2C1=O)N(C(C)=O)C([H])([H])c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1227 |
| logD: | 4.0754 |
| logSw: | -4.3597 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.541 |
| InChI Key: | YOFPOQSNSODQKG-UHFFFAOYSA-N |