2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[2-(methylsulfanyl)ethyl]-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[2-(methylsulfanyl)ethyl]-4,5-dihydro-1,3-oxazole
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[2-(methylsulfanyl)ethyl]-4,5-dihydro-1,3-oxazole
Compound characteristics
| Compound ID: | C351-0091 |
| Compound Name: | 2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[2-(methylsulfanyl)ethyl]-4,5-dihydro-1,3-oxazole |
| Molecular Weight: | 352.86 |
| Molecular Formula: | C17 H18 Cl F N2 O S |
| Smiles: | CSCCC1COC(c2cccn2Cc2ccc(cc2[Cl])F)=N1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6052 |
| logD: | 4.6052 |
| logSw: | -4.6892 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.5206 |
| InChI Key: | ZJBPOCIXYOSEFE-CQSZACIVSA-N |