4-({[(2,6-dimethylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
4-({[(2,6-dimethylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
4-({[(2,6-dimethylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0253 |
| Compound Name: | 4-({[(2,6-dimethylphenyl)methyl]sulfanyl}methyl)-2-{1-[(2-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 408.54 |
| Molecular Formula: | C24 H25 F N2 O S |
| Smiles: | Cc1cccc(C)c1CSCC1COC(c2cccn2Cc2ccccc2F)=N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7397 |
| logD: | 6.7396 |
| logSw: | -6.0187 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.2491 |
| InChI Key: | ZUELEFHJNYIZET-HXUWFJFHSA-N |