5H-Pyrido(4,3-b)indole, 1-bromo-
Basic information
- CAS
7369-17-7- Standard SMILES
Brc1nccc2[nH]c3ccccc3c12- InChIKey
MFBUFYFBSKWIAZ-UHFFFAOYSA-N- Molecular formula
- C11H7BrN2
- Average molar mass
- 247.09 g/mol
- Monoisotopic mass
- 245.97926
Names & identifiers
- Preferred name
- 5H-Pyrido(4,3-b)indole, 1-bromo-
- IUPAC
- 1-bromo-5H-pyrido[4,3-b]indole
Names & synonyms
5H-Pyrido(4,3-b)indole, 1-bromo-7369-17-71-Bromo-y-carboline1-bromo-5H-pyrido[4,3-b]indoleDTXSID80223977
Database identifiers
- CAS
7369-17-7- PubChem CID
- 5487684
- DTXSID
DTXSID80223977
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 221
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Compound notes
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