2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-chlorophenyl)butanamide
Chemical Structure Depiction of
2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-chlorophenyl)butanamide
2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-chlorophenyl)butanamide
Compound characteristics
| Compound ID: | K784-2910 |
| Compound Name: | 2-{[5,6-bis(4-methylphenyl)-1,2,4-triazin-3-yl]sulfanyl}-N-(2-chlorophenyl)butanamide |
| Molecular Weight: | 489.04 |
| Molecular Formula: | C27 H25 Cl N4 O S |
| Smiles: | CCC(C(Nc1ccccc1[Cl])=O)Sc1nc(c2ccc(C)cc2)c(c2ccc(C)cc2)nn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7783 |
| logD: | 6.7779 |
| logSw: | -6.2734 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.05 |
| InChI Key: | PDCPAXBJJQZTNQ-QHCPKHFHSA-N |