N-(3-acetylphenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}butanamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}butanamide
N-(3-acetylphenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}butanamide
Compound characteristics
| Compound ID: | F151-0425 |
| Compound Name: | N-(3-acetylphenyl)-2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}butanamide |
| Molecular Weight: | 479.56 |
| Molecular Formula: | C24 H25 N5 O4 S |
| Smiles: | CCC(C(Nc1cccc(c1)C(C)=O)=O)SC1NC(C(c2ccccc2NC(CC)=O)=NN=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.273 |
| logD: | 3.2111 |
| logSw: | -3.6484 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.437 |
| InChI Key: | HQEBTXWUSCNDOR-IBGZPJMESA-N |