ethyl 1-benzyl-3,5-dimethyl-4-[(2-methylpropyl)carbamoyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-benzyl-3,5-dimethyl-4-[(2-methylpropyl)carbamoyl]-1H-pyrrole-2-carboxylate
ethyl 1-benzyl-3,5-dimethyl-4-[(2-methylpropyl)carbamoyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | C722-1006 |
| Compound Name: | ethyl 1-benzyl-3,5-dimethyl-4-[(2-methylpropyl)carbamoyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C21 H28 N2 O3 |
| Smiles: | CCOC(c1c(C)c(C(NCC(C)C)=O)c(C)n1Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8392 |
| logD: | 3.8392 |
| logSw: | -4.1591 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.404 |
| InChI Key: | FHBOYCQKKAYVLN-UHFFFAOYSA-N |