N-cyclohexyl-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-cyclohexyl-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-cyclohexyl-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
Compound ID: | E008-0258 |
Compound Name: | N-cyclohexyl-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
Molecular Weight: | 394.54 |
Molecular Formula: | C22 H26 N4 O S |
Smiles: | C1CCC(CC1)NC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
Stereo: | ACHIRAL |
logP: | 4.9429 |
logD: | 4.9429 |
logSw: | -4.5853 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.02 |
InChI Key: | MJDKFEHVLBBGHJ-UHFFFAOYSA-N |