ethyl 2,4-dimethyl-5-({methyl-N-[(4-methylphenyl)methyl]carbamamido}methyl)-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2,4-dimethyl-5-({methyl-N-[(4-methylphenyl)methyl]carbamamido}methyl)-1H-pyrrole-3-carboxylate
ethyl 2,4-dimethyl-5-({methyl-N-[(4-methylphenyl)methyl]carbamamido}methyl)-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F346-0065 |
| Compound Name: | ethyl 2,4-dimethyl-5-({methyl-N-[(4-methylphenyl)methyl]carbamamido}methyl)-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 357.45 |
| Molecular Formula: | C20 H27 N3 O3 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccc(C)cc2)C(NC)=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.17 |
| logD: | 3.17 |
| logSw: | -3.1531 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.973 |
| InChI Key: | XWAYTMANJJARGE-UHFFFAOYSA-N |