ethyl 1-ethyl-4-[(3-fluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-ethyl-4-[(3-fluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 1-ethyl-4-[(3-fluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0605 |
| Compound Name: | ethyl 1-ethyl-4-[(3-fluorophenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 332.37 |
| Molecular Formula: | C18 H21 F N2 O3 |
| Smiles: | CCn1c(C)c(C(Nc2cccc(c2)F)=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.7042 |
| logD: | 3.6846 |
| logSw: | -4.1822 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.806 |
| InChI Key: | GXEQEUWHMIRZSQ-UHFFFAOYSA-N |