N-(1-benzylpiperidin-4-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
N-(1-benzylpiperidin-4-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | E008-0155 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)acetamide |
| Molecular Weight: | 485.65 |
| Molecular Formula: | C28 H31 N5 O S |
| Smiles: | C1CN(CCC1NC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8468 |
| logD: | 3.2891 |
| logSw: | -4.5993 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.561 |
| InChI Key: | ITSZXQKCIFXGLD-UHFFFAOYSA-N |