ethyl 4-({3-(dimethylamino)-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({3-(dimethylamino)-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({3-(dimethylamino)-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0004 |
| Compound Name: | ethyl 4-({3-(dimethylamino)-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 447.58 |
| Molecular Formula: | C27 H33 N3 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(C)cc2)C(c2cccc(c2)N(C)C)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8909 |
| logD: | 4.8909 |
| logSw: | -4.5973 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.718 |
| InChI Key: | UAENIGLXOLTVJX-UHFFFAOYSA-N |