N-(2,4-dimethylphenyl)-3-[3-({[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide
Chemical Structure Depiction of
N-(2,4-dimethylphenyl)-3-[3-({[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide
N-(2,4-dimethylphenyl)-3-[3-({[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide
Compound characteristics
| Compound ID: | J021-2134 |
| Compound Name: | N-(2,4-dimethylphenyl)-3-[3-({[5-(furan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-1,2,4-oxadiazol-5-yl]propanamide |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C20 H20 N6 O3 S |
| Smiles: | Cc1ccc(c(C)c1)NC(CCc1nc(CSc2nnc(c3ccco3)[nH]2)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5526 |
| logD: | 1.0076 |
| logSw: | -2.8053 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.837 |
| InChI Key: | DBSSETPNFGYNDF-UHFFFAOYSA-N |