ethyl 1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-1901 |
| Compound Name: | ethyl 1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | CCOC(c1cc(c2ccccc2)n(CCC(Nc2nc3ccc(cc3s2)OC)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6988 |
| logD: | 5.6987 |
| logSw: | -5.4767 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.104 |
| InChI Key: | WZYCHTXLXWRUEW-UHFFFAOYSA-N |