1-(4-cyclohexylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one
Chemical Structure Depiction of
1-(4-cyclohexylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one
1-(4-cyclohexylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one
Compound characteristics
| Compound ID: | G819-0010 |
| Compound Name: | 1-(4-cyclohexylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one |
| Molecular Weight: | 479.64 |
| Molecular Formula: | C26 H33 N5 O2 S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CS(Cc1cnn(c2ccccc2)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5949 |
| logD: | 3.3863 |
| logSw: | -3.4631 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.353 |
| InChI Key: | XDFPCWVVXIDABY-UHFFFAOYSA-N |