1-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine
Chemical Structure Depiction of
1-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine
1-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine
Compound characteristics
Compound ID: | F322-0510 |
Compound Name: | 1-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine |
Molecular Weight: | 414.54 |
Molecular Formula: | C21 H22 N2 O3 S2 |
Smiles: | Cc1cc(c2c(c(C)sc2C)S(N2CCC(=CC2)c2ccccc2)(=O)=O)on1 |
Stereo: | ACHIRAL |
logP: | 4.7375 |
logD: | 4.7375 |
logSw: | -4.6215 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 54.038 |
InChI Key: | KENKJGLISMQDMV-UHFFFAOYSA-N |