2-(2,4-dichlorophenyl)-5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(2,4-dichlorophenyl)-5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
2-(2,4-dichlorophenyl)-5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole
Compound characteristics
Compound ID: | 8006-5278 |
Compound Name: | 2-(2,4-dichlorophenyl)-5-{[(4-methoxy-3-nitrophenyl)methyl]sulfanyl}-1,3,4-oxadiazole |
Molecular Weight: | 412.25 |
Molecular Formula: | C16 H11 Cl2 N3 O4 S |
Smiles: | COc1ccc(CSc2nnc(c3ccc(cc3[Cl])[Cl])o2)cc1[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.1973 |
logD: | 4.1973 |
logSw: | -4.6213 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 70.775 |
InChI Key: | CHUHDIHFBYCWJM-UHFFFAOYSA-N |