ethyl 4-({3-chloro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-({3-chloro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-({3-chloro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G798-0007 |
| Compound Name: | ethyl 4-({3-chloro-N-[(4-methylphenyl)methyl]benzamido}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 438.95 |
| Molecular Formula: | C25 H27 Cl N2 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(C)cc2)C(c2cccc(c2)[Cl])=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2361 |
| logD: | 5.2361 |
| logSw: | -5.6694 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.913 |
| InChI Key: | NKOPZXVCGGSCPV-UHFFFAOYSA-N |