2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[(pyridin-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[(pyridin-2-yl)methyl]acetamide
2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[(pyridin-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | G819-0042 |
| Compound Name: | 2-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methanesulfinyl}-N-[(pyridin-2-yl)methyl]acetamide |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C22 H21 N5 O2 S |
| Smiles: | C(c1ccccn1)NC(CS(Cc1cnn(c2ccccc2)c1n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4973 |
| logD: | 2.497 |
| logSw: | -2.5543 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.882 |
| InChI Key: | GRNXEXMKYKVFRD-UHFFFAOYSA-N |