N-[4-(benzenesulfonyl)-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]propanamide
Chemical Structure Depiction of
N-[4-(benzenesulfonyl)-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]propanamide
N-[4-(benzenesulfonyl)-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]propanamide
Compound characteristics
| Compound ID: | C201-0577 |
| Compound Name: | N-[4-(benzenesulfonyl)-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-3-(methylsulfanyl)-1H-pyrazol-5-yl]propanamide |
| Molecular Weight: | 518.61 |
| Molecular Formula: | C23 H26 N4 O6 S2 |
| Smiles: | CCC(Nc1c(c(nn1CC(Nc1ccc(cc1OC)OC)=O)SC)S(c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5216 |
| logD: | 2.5215 |
| logSw: | -3.0542 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 104.023 |
| InChI Key: | YQMFCCLHWYJRED-UHFFFAOYSA-N |