2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)-N-[(pyridin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)-N-[(pyridin-2-yl)methyl]acetamide
2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)-N-[(pyridin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | E008-0062 |
| Compound Name: | 2-({[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}sulfanyl)-N-[(pyridin-2-yl)methyl]acetamide |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C22 H21 N5 O S |
| Smiles: | C(c1ccccn1)NC(CSCc1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8184 |
| logD: | 3.818 |
| logSw: | -3.952 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.838 |
| InChI Key: | LTUJLGCWQLCBBV-UHFFFAOYSA-N |