3-(azepan-1-yl)-3-imino-2-[2-(4-nitrophenyl)hydrazinylidene]propanenitrile
Chemical Structure Depiction of
3-(azepan-1-yl)-3-imino-2-[2-(4-nitrophenyl)hydrazinylidene]propanenitrile
3-(azepan-1-yl)-3-imino-2-[2-(4-nitrophenyl)hydrazinylidene]propanenitrile
Compound characteristics
| Compound ID: | 8008-9211 |
| Compound Name: | 3-(azepan-1-yl)-3-imino-2-[2-(4-nitrophenyl)hydrazinylidene]propanenitrile |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C15 H18 N6 O2 |
| Smiles: | C1CCCN(CC1)C(\C(C#N)=N/Nc1ccc(cc1)[N+]([O-])=O)=N |
| Stereo: | ACHIRAL |
| logP: | 3.4615 |
| logD: | 3.1339 |
| logSw: | -3.6584 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.024 |
| InChI Key: | KSQGLTFLYUNMBR-UHFFFAOYSA-N |