2,2'-((4,4'-Bipiperidine)-1,1'-diyldi-2,1-ethanediyl)bis-7H-pyrido(4,3-c)carbazolium dichloride
Basic information
- CAS
74517-50-3- Standard SMILES
C1=CC2=c3c(ccc4c3=CN(CCN3CCC(C5CCN(CCN6C=Cc7ccc8c(c7=C6)=C6C=CC=CC6[NH2+]8)CC5)CC3)C=C4)[NH2+]C2C=C1.[Cl-].[Cl-]- InChIKey
GPRBCACVGJYHOR-UHFFFAOYSA-N- Molecular formula
- C44H50Cl2N6
- Average molar mass
- 733.8 g/mol
- Monoisotopic mass
- 732.347401
Names & identifiers
- Preferred name
- 2,2'-((4,4'-Bipiperidine)-1,1'-diyldi-2,1-ethanediyl)bis-7H-pyrido(4,3-c)carbazolium dichloride
- IUPAC
- 2-[2-[4-[1-[2-(7,7a-dihydropyrido[4,3-c]carbazol-7-ium-2-yl)ethyl]piperidin-4-yl]piperidin-1-yl]ethyl]-7,7a-dihydropyrido[4,3-c]carbazol-7-ium dichloride
Names & synonyms
74517-50-32,2'-((4,4'-Bipiperidine)-1,1'-diyldi-2,1-ethanediyl)bis-7H-pyrido(4,3-c)carbazolium dichloride7H-Pyrido(4,3-c)carbazolium, 2,2'-((4,4'-bipiperidine)-1,1'-diyldi-2,1-ethanediyl)bis-, dichloride
Database identifiers
- CAS
74517-50-3- PubChem CID
- 150807
Properties
Computed structural properties
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 52
- Formal charge
- 0
- Complexity
- 1,760
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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