1-(4-cyclohexylpiperazin-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-(4-cyclohexylpiperazin-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
1-(4-cyclohexylpiperazin-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | E008-0017 |
| Compound Name: | 1-(4-cyclohexylpiperazin-1-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)ethan-1-one |
| Molecular Weight: | 463.64 |
| Molecular Formula: | C26 H33 N5 O S |
| Smiles: | C1CCC(CC1)N1CCN(CC1)C(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9025 |
| logD: | 4.7934 |
| logSw: | -4.5147 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.309 |
| InChI Key: | RZKKWVGEPDXVNF-UHFFFAOYSA-N |