ethyl 5-({4-cyano-N-[(4-methoxyphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-({4-cyano-N-[(4-methoxyphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-({4-cyano-N-[(4-methoxyphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F347-0526 |
| Compound Name: | ethyl 5-({4-cyano-N-[(4-methoxyphenyl)methyl]benzamido}methyl)-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C26 H27 N3 O4 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(cc2)OC)C(c2ccc(C#N)cc2)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5982 |
| logD: | 3.5982 |
| logSw: | -3.697 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.008 |
| InChI Key: | PLCCITOIIASFNG-UHFFFAOYSA-N |