2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-({[(3-methylphenyl)methyl]sulfanyl}methyl)-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-({[(3-methylphenyl)methyl]sulfanyl}methyl)-4,5-dihydro-1,3-oxazole
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-({[(3-methylphenyl)methyl]sulfanyl}methyl)-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0263 |
| Compound Name: | 2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-({[(3-methylphenyl)methyl]sulfanyl}methyl)-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 428.95 |
| Molecular Formula: | C23 H22 Cl F N2 O S |
| Smiles: | Cc1cccc(CSCC2COC(c3cccn3Cc3ccc(cc3[Cl])F)=N2)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7326 |
| logD: | 6.7326 |
| logSw: | -6.4688 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.2491 |
| InChI Key: | WMMUOBSKMMEXNK-FQEVSTJZSA-N |