ethyl 5-({4-ethoxy-N-[(4-methylphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({4-ethoxy-N-[(4-methylphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-({4-ethoxy-N-[(4-methylphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F347-0034 |
| Compound Name: | ethyl 5-({4-ethoxy-N-[(4-methylphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 448.56 |
| Molecular Formula: | C27 H32 N2 O4 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(C)cc2)C(c2ccc(cc2)OCC)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7538 |
| logD: | 4.7538 |
| logSw: | -4.5565 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.532 |
| InChI Key: | NXAKTAKQKLPNQD-UHFFFAOYSA-N |