N-{[4-(methylsulfanyl)phenyl]methyl}-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide
N-{[4-(methylsulfanyl)phenyl]methyl}-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | G819-0234 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 464.61 |
| Molecular Formula: | C24 H24 N4 O2 S2 |
| Smiles: | CSc1ccc(CNC(CS(Cc2cnn(c3ccccc3)c2n2cccc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1264 |
| logD: | 4.1264 |
| logSw: | -4.042 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.339 |
| InChI Key: | GSGPPPCUWXWMAV-UHFFFAOYSA-N |