N-(4-chlorophenyl)-3-[3-({[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-3-[3-({[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide
N-(4-chlorophenyl)-3-[3-({[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide
Compound characteristics
| Compound ID: | J021-3125 |
| Compound Name: | N-(4-chlorophenyl)-3-[3-({[5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide |
| Molecular Weight: | 458.9 |
| Molecular Formula: | C20 H16 Cl F N6 O2 S |
| Smiles: | C(Cc1nc(CSc2nnc(c3ccc(cc3)F)[nH]2)no1)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7162 |
| logD: | 2.5155 |
| logSw: | -4.4093 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.957 |
| InChI Key: | XMKDIHNLDRDBFF-UHFFFAOYSA-N |