4-[2-(methylsulfanyl)ethyl]-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
4-[2-(methylsulfanyl)ethyl]-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
4-[2-(methylsulfanyl)ethyl]-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0188 |
| Compound Name: | 4-[2-(methylsulfanyl)ethyl]-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 342.5 |
| Molecular Formula: | C20 H26 N2 O S |
| Smiles: | Cc1cc(C)c(Cn2cccc2C2=NC(CCSC)CO2)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2834 |
| logD: | 5.2834 |
| logSw: | -5.3206 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.5206 |
| InChI Key: | MPNVZEVLYLNZOL-KRWDZBQOSA-N |