N-(3-chloro-2-methylphenyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
N-(3-chloro-2-methylphenyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C226-4165 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 340.79 |
| Molecular Formula: | C13 H13 Cl N4 O3 S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSc1c(c(C)n[nH]1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0126 |
| logD: | 3.002 |
| logSw: | -3.4824 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.668 |
| InChI Key: | GVAQLXOZMSNEHF-UHFFFAOYSA-N |