ethyl 4-[(5-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(5-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(5-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0190 |
| Compound Name: | ethyl 4-[(5-chloro-2-methylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 334.8 |
| Molecular Formula: | C17 H19 Cl N2 O3 |
| Smiles: | [H]n1c(C)c(C(Nc2cc(ccc2C)[Cl])=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.771 |
| logD: | 3.7213 |
| logSw: | -4.598 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.367 |
| InChI Key: | IOVOIRLOISFDNZ-UHFFFAOYSA-N |