ethyl 3,5-dimethyl-4-[3-({[4-(methylsulfanyl)phenyl]methyl}amino)-3-oxopropyl]-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-[3-({[4-(methylsulfanyl)phenyl]methyl}amino)-3-oxopropyl]-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-[3-({[4-(methylsulfanyl)phenyl]methyl}amino)-3-oxopropyl]-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0275 |
| Compound Name: | ethyl 3,5-dimethyl-4-[3-({[4-(methylsulfanyl)phenyl]methyl}amino)-3-oxopropyl]-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C20 H26 N2 O3 S |
| Smiles: | CCOC(c1c(C)c(CCC(NCc2ccc(cc2)SC)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6839 |
| logD: | 3.6839 |
| logSw: | -3.8666 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.174 |
| InChI Key: | LCLRFDOSLBAVAQ-UHFFFAOYSA-N |