ethyl 4-[(3-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(3-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(3-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E137-0098 |
| Compound Name: | ethyl 4-[(3-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 334.8 |
| Molecular Formula: | C17 H19 Cl N2 O3 |
| Smiles: | CCOC(c1c(C)c(C(Nc2cccc(c2C)[Cl])=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1212 |
| logD: | 4.0715 |
| logSw: | -4.5413 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.367 |
| InChI Key: | QBWZBUASVSRUHO-UHFFFAOYSA-N |