ethyl 4-({4-fluoro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({4-fluoro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({4-fluoro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0077 |
| Compound Name: | ethyl 4-({4-fluoro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C25 H27 F N2 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(C)cc2)C(c2ccc(cc2)F)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6865 |
| logD: | 4.6865 |
| logSw: | -4.3222 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.913 |
| InChI Key: | DJJVUGTXOQVOPR-UHFFFAOYSA-N |