ethyl 4-[(N-benzyl-2-methylpropanamido)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[(N-benzyl-2-methylpropanamido)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[(N-benzyl-2-methylpropanamido)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0488 |
| Compound Name: | ethyl 4-[(N-benzyl-2-methylpropanamido)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C21 H28 N2 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccccc2)C(C(C)C)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8657 |
| logD: | 3.8657 |
| logSw: | -3.9404 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.185 |
| InChI Key: | LGOVJNJSQIWGRD-UHFFFAOYSA-N |