2-[4-(2-Pyridinyl)-1-piperazinyl]cycloheptimidazole
Basic information
- CAS
77723-13-8- Standard SMILES
c1ccc2nc(N3CCN(c4ccccn4)CC3)nc-2cc1- InChIKey
ONNQTTOFLXQSQB-UHFFFAOYSA-N- Molecular formula
- C17H17N5
- Average molar mass
- 291.35 g/mol
- Monoisotopic mass
- 291.14839556
Names & identifiers
- Preferred name
- 2-[4-(2-Pyridinyl)-1-piperazinyl]cycloheptimidazole
- IUPAC
- 2-(4-pyridin-2-ylpiperazin-1-yl)cyclohepta[d]imidazole
Names & synonyms
2-[4-(2-Pyridinyl)-1-piperazinyl]cycloheptimidazoleSCHEMBL11395686DTXSID80122251477723-13-82-[4-(Pyridin-2-yl)piperazin-1-yl]cyclohepta[d]imidazole
Database identifiers
- CAS
77723-13-8- PubChem CID
- 15917707
- DTXSID
DTXSID801222514
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 341
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Compound notes
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