N-(2-cyanoethyl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
N-(2-cyanoethyl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-phenylacetamide
N-(2-cyanoethyl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | D344-9191 |
| Compound Name: | N-(2-cyanoethyl)-2-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C19 H15 N5 O4 S |
| Smiles: | C(CN(C(CSc1nnc(c2ccc(cc2)[N+]([O-])=O)o1)=O)c1ccccc1)C#N |
| Stereo: | ACHIRAL |
| logP: | 2.6437 |
| logD: | 2.6437 |
| logSw: | -3.0134 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 96.283 |
| InChI Key: | HGYYFXACILXWBL-UHFFFAOYSA-N |