4-bromo-7-chloro-5H-pyrido[4,3-b]indol-1-ol
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Basic information
- Standard SMILES
O=c1[nH]cc(Br)c2[nH]c3cc(Cl)ccc3c12- InChIKey
RUTMXFDTXGWNEW-UHFFFAOYSA-N- Molecular formula
- C11H6BrClN2O
- Average molar mass
- 297.53 g/mol
- Monoisotopic mass
- 295.9352
Names & identifiers
- Preferred name
- 4-bromo-7-chloro-5H-pyrido[4,3-b]indol-1-ol
- IUPAC
- 4-bromo-7-chloro-2,5-dihydropyrido[4,3-b]indol-1-one
Names & synonyms
SCHEMBL3505546SCHEMBL3609960RUTMXFDTXGWNEW-UHFFFAOYSA-N4-bromo-7-chloro-5H-pyrido[4,3-b]indol-1-ol4-Bromo-7-chloro-2,5-dihydro-1H-pyrido[4,3-b]indol-1-one
Database identifiers
- PubChem CID
- 56595058
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 360
Related reactions
3 records
Compound notes
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