N-(3,4-dimethylphenyl)-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-(3,4-dimethylphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide
N-(3,4-dimethylphenyl)-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: | F367-0230 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-{[5-oxo-4-(2-phenylethyl)-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl]sulfanyl}acetamide |
| Molecular Weight: | 483.59 |
| Molecular Formula: | C27 H25 N5 O2 S |
| Smiles: | Cc1ccc(cc1C)NC(CSc1nnc2N(CCc3ccccc3)C(c3ccccc3n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9814 |
| logD: | 4.9814 |
| logSw: | -4.5087 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.44 |
| InChI Key: | ZCTHMJHOMZCLDV-UHFFFAOYSA-N |