ethyl 5-{[N-benzyl(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[N-benzyl(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
ethyl 5-{[N-benzyl(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | F346-0093 |
| Compound Name: | ethyl 5-{[N-benzyl(5-chloro-2,4-dimethoxyphenyl)carbamamido]methyl}-2,4-dimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 499.99 |
| Molecular Formula: | C26 H30 Cl N3 O5 |
| Smiles: | CCOC(c1c(C)c(CN(Cc2ccccc2)C(Nc2cc(c(cc2OC)OC)[Cl])=O)[nH]c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0542 |
| logD: | 5.054 |
| logSw: | -5.5658 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.792 |
| InChI Key: | PTNVSQRDKGEZHU-UHFFFAOYSA-N |