1-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine
Chemical Structure Depiction of
1-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine
1-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine
Compound characteristics
Compound ID: | F322-0117 |
Compound Name: | 1-[2,5-dimethyl-4-(1,2-oxazol-5-yl)thiophene-3-sulfonyl]-4-phenyl-1,2,3,6-tetrahydropyridine |
Molecular Weight: | 400.52 |
Molecular Formula: | C20 H20 N2 O3 S2 |
Smiles: | Cc1c(c(c(C)s1)S(N1CCC(=CC1)c1ccccc1)(=O)=O)c1ccno1 |
Stereo: | ACHIRAL |
logP: | 4.0773 |
logD: | 4.0773 |
logSw: | -4.2946 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 54.565 |
InChI Key: | HGRHBSHLWUPEHV-UHFFFAOYSA-N |