1-(4-ethylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one
Chemical Structure Depiction of
1-(4-ethylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one
1-(4-ethylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one
Compound characteristics
| Compound ID: | G819-0029 |
| Compound Name: | 1-(4-ethylpiperazin-1-yl)-2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}ethan-1-one |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C22 H27 N5 O2 S |
| Smiles: | CCN1CCN(CC1)C(CS(Cc1cnn(c2ccccc2)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1006 |
| logD: | 1.8752 |
| logSw: | -2.2671 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.797 |
| InChI Key: | XKVUNWANWSPMLN-UHFFFAOYSA-N |