ethyl 4-[3-(5-chloro-2,4-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-(5-chloro-2,4-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
ethyl 4-[3-(5-chloro-2,4-dimethoxyanilino)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0080 |
| Compound Name: | ethyl 4-[3-(5-chloro-2,4-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(Nc2cc(c(cc2OC)OC)[Cl])=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5632 |
| logD: | 3.5366 |
| logSw: | -3.5851 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.414 |
| InChI Key: | UUALKSLBQBCNRH-UHFFFAOYSA-N |