ethyl 5-[(N-benzylbutanamido)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(N-benzylbutanamido)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-[(N-benzylbutanamido)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F347-0151 |
| Compound Name: | ethyl 5-[(N-benzylbutanamido)methyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 356.46 |
| Molecular Formula: | C21 H28 N2 O3 |
| Smiles: | CCCC(N(Cc1ccccc1)Cc1c(C)c(C(=O)OCC)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7044 |
| logD: | 3.7044 |
| logSw: | -3.9509 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.153 |
| InChI Key: | WFYBEHDGIHBBPQ-UHFFFAOYSA-N |