Basic information
- CAS
111380-41-7- Standard SMILES
CN(C)CCCNc1nccc2[nH]c3ccc(O)cc3c12- InChIKey
UTUWDTGTORKSAW-UHFFFAOYSA-N- Molecular formula
- C16H20N4O
- Average molar mass
- 284.36 g/mol
- Monoisotopic mass
- 284.16371127
Names & identifiers
- Preferred name
- 5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)-
- IUPAC
- 1-[3-(dimethylamino)propylamino]-5H-pyrido[4,3-b]indol-8-ol
Names & synonyms
5H-Pyrido(4,3-b)indol-8-ol, 1-((3-(dimethylamino)propyl)amino)-111380-41-7CHEMBL130461
Database identifiers
- CAS
111380-41-7- PubChem CID
- 183302
- ChEMBL
CHEMBL130461
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 64.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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