2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide
Chemical Structure Depiction of
2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide
2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide
Compound characteristics
| Compound ID: | M191-0058 |
| Compound Name: | 2-[(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N-(4H-1,2,4-triazol-3-yl)acetamide |
| Molecular Weight: | 378.41 |
| Molecular Formula: | C18 H14 N6 O2 S |
| Smiles: | C(C(Nc1nnc[nH]1)=O)SC1=Nc2ccccc2C(N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5658 |
| logD: | 0.5513 |
| logSw: | -2.3859 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.146 |
| InChI Key: | JBGKOOVFOFDNJJ-UHFFFAOYSA-N |