N-(4-acetamidophenyl)-2-{[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-2-{[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
N-(4-acetamidophenyl)-2-{[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | J084-0865 |
| Compound Name: | N-(4-acetamidophenyl)-2-{[5-(4-methylphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 482.56 |
| Molecular Formula: | C26 H22 N6 O2 S |
| Smiles: | CC(Nc1ccc(cc1)NC(CSc1nnc2c3ccccc3nc(c3ccc(C)cc3)n12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4848 |
| logD: | 4.4555 |
| logSw: | -4.2508 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.721 |
| InChI Key: | DCFHIIBLSSTQLG-UHFFFAOYSA-N |