Basic information
- CAS
111380-32-6- Standard SMILES
CCN(CC)CCNc1ncc(C)c2c1c1cc(OC)ccc1n2C.Cl.Cl- InChIKey
IYLOGUDECFFVQO-UHFFFAOYSA-N- Molecular formula
- C20H30Cl2N4O
- Average molar mass
- 413.4 g/mol
- Monoisotopic mass
- 412.179667
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N,N-diethyl-N'-(8-methoxy-4,5-dimethyl-5H-pyrido(4,3-b)indol-1-yl)-, dihydrochloride
- IUPAC
- N',N'-diethyl-N-(8-methoxy-4,5-dimethylpyrido[4,3-b]indol-1-yl)ethane-1,2-diamine;dihydrochloride
Names & synonyms
1,2-Ethanediamine, N,N-diethyl-N'-(8-methoxy-4,5-dimethyl-5H-pyrido(4,3-b)indol-1-yl)-, dihydrochloride111380-32-6SCHEMBL10544729DTXSID801496231-(2-Diethylaminoethyl)amino-4,5-dimethyl-8-methoxy-5H-pyrido(4,3-b)indole dihydrochlorideN~1~,N~1~-Diethyl-N~2~-(8-methoxy-4,5-dimethyl-5H-pyrido[4,3-b]indol-1-yl)ethane-1,2-diamine--hydrogen chloride (1/2)
Database identifiers
- CAS
111380-32-6- PubChem CID
- 183288
- DTXSID
DTXSID80149623
Properties
Computed structural properties
- Topological polar surface area
- 42.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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