ethyl 3,5-dimethyl-4-{3-[3-(methylsulfanyl)anilino]-3-oxopropyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 3,5-dimethyl-4-{3-[3-(methylsulfanyl)anilino]-3-oxopropyl}-1H-pyrrole-2-carboxylate
ethyl 3,5-dimethyl-4-{3-[3-(methylsulfanyl)anilino]-3-oxopropyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | G793-0143 |
| Compound Name: | ethyl 3,5-dimethyl-4-{3-[3-(methylsulfanyl)anilino]-3-oxopropyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 360.47 |
| Molecular Formula: | C19 H24 N2 O3 S |
| Smiles: | CCOC(c1c(C)c(CCC(Nc2cccc(c2)SC)=O)c(C)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7253 |
| logD: | 3.7253 |
| logSw: | -3.9843 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.851 |
| InChI Key: | LFULPIMTPGHCJK-UHFFFAOYSA-N |