N-[2-(4-chlorophenyl)ethyl]-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide
N-[2-(4-chlorophenyl)ethyl]-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide
Compound characteristics
| Compound ID: | G819-0069 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}acetamide |
| Molecular Weight: | 466.99 |
| Molecular Formula: | C24 H23 Cl N4 O2 S |
| Smiles: | C(CNC(CS(Cc1cnn(c2ccccc2)c1n1cccc1)=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7765 |
| logD: | 3.7765 |
| logSw: | -4.4433 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.181 |
| InChI Key: | RFDLFAYETYJNQC-UHFFFAOYSA-N |