4-({[(4-methylphenyl)methyl]sulfanyl}methyl)-2-(1-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
4-({[(4-methylphenyl)methyl]sulfanyl}methyl)-2-(1-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole
4-({[(4-methylphenyl)methyl]sulfanyl}methyl)-2-(1-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0294 |
| Compound Name: | 4-({[(4-methylphenyl)methyl]sulfanyl}methyl)-2-(1-{[4-(methylsulfanyl)phenyl]methyl}-1H-pyrrol-2-yl)-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 422.61 |
| Molecular Formula: | C24 H26 N2 O S2 |
| Smiles: | Cc1ccc(CSCC2COC(c3cccn3Cc3ccc(cc3)SC)=N2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0619 |
| logD: | 6.0618 |
| logSw: | -5.641 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 20.2491 |
| InChI Key: | PVCKNWPJZUWTPA-OAQYLSRUSA-N |