ethyl 4-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0222 |
| Compound Name: | ethyl 4-[3-(2-chloro-4,6-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 408.88 |
| Molecular Formula: | C20 H25 Cl N2 O5 |
| Smiles: | CCOC(c1c(C)c(CCC(Nc2c(cc(cc2[Cl])OC)OC)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2338 |
| logD: | 3.2068 |
| logSw: | -3.3531 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.63 |
| InChI Key: | DMAUZKLOYMFJLT-UHFFFAOYSA-N |