4,6-dimethyl-2-({[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)pyridine-3-carbonitrile
Chemical Structure Depiction of
4,6-dimethyl-2-({[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)pyridine-3-carbonitrile
4,6-dimethyl-2-({[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4729-0514 |
| Compound Name: | 4,6-dimethyl-2-({[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl}sulfanyl)pyridine-3-carbonitrile |
| Molecular Weight: | 367.38 |
| Molecular Formula: | C17 H13 N5 O3 S |
| Smiles: | Cc1cc(C)nc(c1C#N)SCc1nnc(c2ccc(cc2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.3789 |
| logD: | 3.3789 |
| logSw: | -3.6319 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 89.14 |
| InChI Key: | JKJPWVKYTQLTAV-UHFFFAOYSA-N |