ethyl 5-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate
ethyl 5-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 8010-3681 |
| Compound Name: | ethyl 5-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetamido}-1-phenyl-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 482.58 |
| Molecular Formula: | C23 H22 N4 O4 S2 |
| Smiles: | CCOC(c1cnn(c2ccccc2)c1NC(CSc1nc2ccc(cc2s1)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4105 |
| logD: | 5.363 |
| logSw: | -5.2307 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.812 |
| InChI Key: | RPPGXEPMRRYJIH-UHFFFAOYSA-N |