2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[(ethylsulfanyl)methyl]-4,5-dihydro-1,3-oxazole
Chemical Structure Depiction of
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[(ethylsulfanyl)methyl]-4,5-dihydro-1,3-oxazole
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[(ethylsulfanyl)methyl]-4,5-dihydro-1,3-oxazole
Compound characteristics
Compound ID: | C351-0142 |
Compound Name: | 2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-pyrrol-2-yl}-4-[(ethylsulfanyl)methyl]-4,5-dihydro-1,3-oxazole |
Molecular Weight: | 352.86 |
Molecular Formula: | C17 H18 Cl F N2 O S |
Smiles: | CCSCC1COC(c2cccn2Cc2ccc(cc2[Cl])F)=N1 |
Stereo: | RACEMIC MIXTURE |
logP: | 4.84 |
logD: | 4.8399 |
logSw: | -4.9598 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 20.5206 |
InChI Key: | ZAQKNSFCRGWTBH-AWEZNQCLSA-N |