2-[(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(butan-2-yl)acetamide
Chemical Structure Depiction of
2-[(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(butan-2-yl)acetamide
2-[(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(butan-2-yl)acetamide
Compound characteristics
| Compound ID: | F367-0159 |
| Compound Name: | 2-[(4-benzyl-5-oxo-4,5-dihydro[1,2,4]triazolo[4,3-a]quinazolin-1-yl)sulfanyl]-N-(butan-2-yl)acetamide |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C22 H23 N5 O2 S |
| Smiles: | CCC(C)NC(CSc1nnc2N(Cc3ccccc3)C(c3ccccc3n12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0421 |
| logD: | 3.0421 |
| logSw: | -3.6214 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.496 |
| InChI Key: | IQSXDMLPJAFFJS-HNNXBMFYSA-N |