N-methyl-2-{[4-methyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
N-methyl-2-{[4-methyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
N-methyl-2-{[4-methyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | L849-1750 |
| Compound Name: | N-methyl-2-{[4-methyl-5-(1-methyl-3-phenyl-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 432.55 |
| Molecular Formula: | C23 H24 N6 O S |
| Smiles: | Cc1cccc(c1)N(C)C(CSc1nnc(c2cn(C)nc2c2ccccc2)n1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0072 |
| logD: | 3.0072 |
| logSw: | -3.257 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.248 |
| InChI Key: | FKUGMFHZORRQHO-UHFFFAOYSA-N |