2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | C226-4170 |
| Compound Name: | 2-[(3-methyl-4-nitro-1H-pyrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide |
| Molecular Weight: | 360.31 |
| Molecular Formula: | C13 H11 F3 N4 O3 S |
| Smiles: | Cc1c(c([nH]n1)SCC(Nc1cccc(c1)C(F)(F)F)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2485 |
| logD: | 3.2379 |
| logSw: | -3.6897 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.366 |
| InChI Key: | OFDZAAAHVQRFEY-UHFFFAOYSA-N |