N-(4-acetylphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetylphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
N-(4-acetylphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F367-0251 |
| Compound Name: | N-(4-acetylphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide |
| Molecular Weight: | 497.58 |
| Molecular Formula: | C27 H23 N5 O3 S |
| Smiles: | CC(c1ccc(cc1)NC(CSc1nnc2N(CCc3ccccc3)C(c3ccccc3n12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5361 |
| logD: | 3.5359 |
| logSw: | -3.8477 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.266 |
| InChI Key: | HSSNQJITUXACAR-UHFFFAOYSA-N |