ethyl 4-[butyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[butyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[butyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-0116 |
| Compound Name: | ethyl 4-[butyl(phenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C20 H26 N2 O3 |
| Smiles: | [H]n1c(C)c(C(N(CCCC)c2ccccc2)=O)c(C)c1C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.2252 |
| logD: | 4.2252 |
| logSw: | -4.0111 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.575 |
| InChI Key: | QFZLOAGOXQMLCC-UHFFFAOYSA-N |