4-({[(4-fluorophenyl)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-({[(4-fluorophenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
4-({[(4-fluorophenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0305 |
| Compound Name: | 4-({[(4-fluorophenyl)methyl]sulfanyl}methyl)-2-{1-[(2,4,6-trimethylphenyl)methyl]-1H-pyrrol-2-yl}-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 422.56 |
| Molecular Formula: | C25 H27 F N2 O S |
| Smiles: | Cc1cc(C)c(Cn2cccc2C2=NC(CO2)CSCc2ccc(cc2)F)c(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5157 |
| logD: | 6.5157 |
| logSw: | -5.8134 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.2491 |
| InChI Key: | NTYBIRXGNCTQEM-JOCHJYFZSA-N |