2,6-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Chemical Structure Depiction of
2,6-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
2,6-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate
Compound characteristics
Compound ID: | D421-1821 |
Compound Name: | 2,6-dimethylphenyl {[5-(benzamidomethyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetate |
Molecular Weight: | 397.45 |
Molecular Formula: | C20 H19 N3 O4 S |
Smiles: | Cc1cccc(C)c1OC(CSc1nnc(CNC(c2ccccc2)=O)o1)=O |
Stereo: | ACHIRAL |
logP: | 3.1096 |
logD: | 3.1096 |
logSw: | -3.3028 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.642 |
InChI Key: | NVZYDLLSASBITK-UHFFFAOYSA-N |