2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | Y501-1239 |
| Compound Name: | 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-[2-(phenylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C19 H18 N4 O3 S |
| Smiles: | Cc1c(c(C)n(CC(Nc2ccccc2Sc2ccccc2)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2382 |
| logD: | 3.2382 |
| logSw: | -3.5533 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.48 |
| InChI Key: | ORVNTEDYDWAMOX-UHFFFAOYSA-N |