3-ethyl-1-phenyl-6-(4-piperazin-1-ylphenyl)indazole
C25H26N4 — CID 56666739
Data last refreshed: (MolForge compound catalog, from PubChem)
About 3-ethyl-1-phenyl-6-(4-piperazin-1-ylphenyl)indazole
3-ethyl-1-phenyl-6-(4-piperazin-1-ylphenyl)indazole (PubChem CID 56666739) has the molecular formula C25H26N4 and a molecular weight of 382.51 g/mol. Its IUPAC name is 3-ethyl-1-phenyl-6-(4-piperazin-1-ylphenyl)indazole.
Molecular Properties
| Compound Name | 3-ethyl-1-phenyl-6-(4-piperazin-1-ylphenyl)indazole |
|---|---|
| PubChem CID | 56666739 |
| Molecular Formula | C25H26N4 |
| Molecular Weight | 382.51 g/mol |
| Exact Mass | 382.22 |
| IUPAC Name | 3-ethyl-1-phenyl-6-(4-piperazin-1-ylphenyl)indazole |
| SMILES | CCc1nn(-c2ccccc2)c2cc(-c3ccc(N4CCNCC4)cc3)ccc12 |
| InChI | InChI=1S/C25H26N4/c1-2-24-23-13-10-20(18-25(23)29(27-24)22-6-4-3-5-7-22)19-8-11-21(12-9-19)28-16-14-26-15-17-28/h3-13,18,26H,2,14-17H2,1H3 |
| InChIKey | XWRIHDXIHXAJHC-UHFFFAOYSA-N |
| XLogP | 4.66 |
| TPSA | 33.09 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 29 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 382.51 |
| LogP ≤ 5 | 4.66 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Frequently Asked Questions
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Sources
- PubChem CID 56666739 — identifiers, structure, computed properties (public domain)
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