N-(4-fluorophenyl)-3-(3-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-3-(3-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
N-(4-fluorophenyl)-3-(3-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide
Compound characteristics
Compound ID: | J021-1417 |
Compound Name: | N-(4-fluorophenyl)-3-(3-{[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,2,4-oxadiazol-5-yl)propanamide |
Molecular Weight: | 362.38 |
Molecular Formula: | C15 H15 F N6 O2 S |
Smiles: | Cc1nnc([nH]1)SCc1nc(CCC(Nc2ccc(cc2)F)=O)on1 |
Stereo: | ACHIRAL |
logP: | 1.3504 |
logD: | 0.9252 |
logSw: | -2.2866 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 87.841 |
InChI Key: | LQGKQNCXDVHOFW-UHFFFAOYSA-N |