3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-methoxyphenyl)propanamide
Chemical Structure Depiction of
3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-methoxyphenyl)propanamide
3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-methoxyphenyl)propanamide
Compound characteristics
| Compound ID: | C741-0696 |
| Compound Name: | 3-{4-[(2-chlorophenyl)methyl]-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl}-N-(4-methoxyphenyl)propanamide |
| Molecular Weight: | 487.94 |
| Molecular Formula: | C26 H22 Cl N5 O3 |
| Smiles: | COc1ccc(cc1)NC(CCc1nnc2N(Cc3ccccc3[Cl])C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6655 |
| logD: | 3.6655 |
| logSw: | -4.0785 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.399 |
| InChI Key: | OEPGNYQNSDJIHM-UHFFFAOYSA-N |