3-(adamantan-1-yl)-N'-[(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide
Chemical Structure Depiction of
3-(adamantan-1-yl)-N'-[(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide
3-(adamantan-1-yl)-N'-[(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide
Compound characteristics
| Compound ID: | 2322-1994 |
| Compound Name: | 3-(adamantan-1-yl)-N'-[(3-nitrophenyl)methylidene]-1H-pyrazole-5-carbohydrazide |
| Molecular Weight: | 393.44 |
| Molecular Formula: | C21 H23 N5 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)c1cc(C(N/N=C/c2cccc(c2)[N+]([O-])=O)=O)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 5.1203 |
| logD: | 5.1175 |
| logSw: | -5.4561 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.459 |
| InChI Key: | VRYKJEQLXMNJBD-UHFFFAOYSA-N |