Basic information
- CAS
5869-89-6- Standard SMILES
CCc1c(C)c(C#N)c2nc3ccccc3n2c1N1CCN(C/C=C/c2ccccc2)CC1- InChIKey
NYPBGSUNIGYVQK-FMIVXFBMSA-N- Molecular formula
- C28H29N5
- Average molar mass
- 435.6 g/mol
- Monoisotopic mass
- 435.24229595
Names & identifiers
- Preferred name
- AC1Q2Swb
- IUPAC
- 2-ethyl-3-methyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrile
Names & synonyms
AC1Q2SWB5869-89-6DTXSID50359691RefChem:314205DTXCID703107442-ethyl-3-methyl-1-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}pyrido[1,2-a]benzimidazole-4-carbonitrileSTK106102AKOS0013297862-ethyl-3-methyl-1-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrido[1,2-a]benzimidazole-4-carbonitrileST50056212SR-01000433940SR-01000433940-1
Show more names
Z57235246(E)-1-(4-cinnamylpiperazin-1-yl)-2-ethyl-3-methylbenzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile2-ethyl-3-methyl-1-[4-(3-phenyl-2-propen-1-yl)-1-piperazinyl]pyrido[1,2-a]benzimidazole-4-carbonitrile2-ETHYL-3-METHYL-1-{4-[(2E)-3-PHENYL-2-PROPENYL]-1-PIPERAZINYL}PYRIDO[1,2-A]BENZIMIDAZOLE-4-CARBONITRILE2-Ethyl-3-methyl-1-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}pyrido[1,2-a][1,3]benzimidazole-4-carbonitrile4-[4-((2E)-3-phenylprop-2-enyl)piperazinyl]-3-ethyl-2-methyl-5-hydropyridino[1 ,2-a]benzimidazolecarbonitrile
Database identifiers
- CAS
5869-89-6- PubChem CID
- 984271
- DTXSID
DTXSID50359691- EC Number
- 165-494-3
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 713
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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