4-({[(2-methylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
4-({[(2-methylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
4-({[(2-methylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0311 |
| Compound Name: | 4-({[(2-methylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 418.6 |
| Molecular Formula: | C26 H30 N2 O S |
| Smiles: | Cc1cc(C)c(Cn2cccc2C2=NC(CO2)CSCc2ccccc2C)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4448 |
| logD: | 7.4448 |
| logSw: | -5.8008 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.2491 |
| InChI Key: | KCIVVQMTCWMUAP-HSZRJFAPSA-N |