N-(2-ethylphenyl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-(2-ethylphenyl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
Compound ID: | E008-0099 |
Compound Name: | N-(2-ethylphenyl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
Molecular Weight: | 416.54 |
Molecular Formula: | C24 H24 N4 O S |
Smiles: | CCc1ccccc1NC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.5465 |
logD: | 5.5465 |
logSw: | -5.2788 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.275 |
InChI Key: | RMOHSKMIMGDHGA-UHFFFAOYSA-N |