1-(3-Dimethylaminopropyl)amino-4-methyl-5H-pyrido(4,3-b)indole dimaleate
Basic information
- CAS
111380-14-4- Standard SMILES
Cc1cnc(NCCCN(C)C)c2c1[nH]c1ccccc12.O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O- InChIKey
ZOEDXAUTMJAYRA-LVEZLNDCSA-N- Molecular formula
- C25H30N4O8
- Average molar mass
- 514.5 g/mol
- Monoisotopic mass
- 514.20636393
Names & identifiers
- Preferred name
- 1-(3-Dimethylaminopropyl)amino-4-methyl-5H-pyrido(4,3-b)indole dimaleate
- IUPAC
- bis((E)-but-2-enedioic acid);N',N'-dimethyl-N-(4-methyl-5H-pyrido[4,3-b]indol-1-yl)propane-1,3-diamine
Names & synonyms
1-(3-Dimethylaminopropyl)amino-4-methyl-5H-pyrido(4,3-b)indole dimaleate111380-14-41,3-Propanediamine, N,N-dimethyl-N'-(4-methyl-5H-pyrido(4,3-b)indol-1-yl)-, (Z)-2-butenedioate (1:2)
Database identifiers
- CAS
111380-14-4- PubChem CID
- 6442785
Properties
Computed structural properties
- Topological polar surface area
- 193 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 452
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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