ethyl 5-(4-fluorophenyl)-1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-fluorophenyl)-1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-1H-pyrrole-3-carboxylate
ethyl 5-(4-fluorophenyl)-1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-3225 |
| Compound Name: | ethyl 5-(4-fluorophenyl)-1-{3-[(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl}-2-methyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 481.55 |
| Molecular Formula: | C25 H24 F N3 O4 S |
| Smiles: | CCOC(c1cc(c2ccc(cc2)F)n(CCC(Nc2nc3ccc(cc3s2)OC)=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8329 |
| logD: | 5.8328 |
| logSw: | -5.5194 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.104 |
| InChI Key: | OSVMATCSDJDYRR-UHFFFAOYSA-N |