ethyl 1-{4-[(3-chloro-4-methylphenyl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[(3-chloro-4-methylphenyl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
ethyl 1-{4-[(3-chloro-4-methylphenyl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | K906-2445 |
| Compound Name: | ethyl 1-{4-[(3-chloro-4-methylphenyl)carbamoyl]phenyl}-2-methyl-5-phenyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 472.97 |
| Molecular Formula: | C28 H25 Cl N2 O3 |
| Smiles: | CCOC(c1cc(c2ccccc2)n(c2ccc(cc2)C(Nc2ccc(C)c(c2)[Cl])=O)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 7.395 |
| logD: | 7.3845 |
| logSw: | -6.2742 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.506 |
| InChI Key: | HHBAZIANKKJLIP-UHFFFAOYSA-N |