methyl 4-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-enoate
Chemical Structure Depiction of
methyl 4-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-enoate
methyl 4-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-enoate
Compound characteristics
| Compound ID: | 8014-2569 |
| Compound Name: | methyl 4-{[5-(2,4-dichlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-enoate |
| Molecular Weight: | 345.2 |
| Molecular Formula: | C13 H10 Cl2 N2 O3 S |
| Smiles: | COC(/C=C/CSc1nnc(c2ccc(cc2[Cl])[Cl])o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5288 |
| logD: | 3.5288 |
| logSw: | -4.0206 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.915 |
| InChI Key: | ZZARSLDUJJWZHT-UHFFFAOYSA-N |