2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-phenylbutanamide
Chemical Structure Depiction of
2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-phenylbutanamide
2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-phenylbutanamide
Compound characteristics
| Compound ID: | F151-0428 |
| Compound Name: | 2-{[5-oxo-6-(2-propanamidophenyl)-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-phenylbutanamide |
| Molecular Weight: | 437.52 |
| Molecular Formula: | C22 H23 N5 O3 S |
| Smiles: | CCC(C(Nc1ccccc1)=O)SC1NC(C(c2ccccc2NC(CC)=O)=NN=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3404 |
| logD: | 3.2784 |
| logSw: | -3.7905 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.61 |
| InChI Key: | OAHZANLPRHASEY-KRWDZBQOSA-N |