Basic information
- CAS
18073-34-2- Standard SMILES
Cc1c2ccncc2c(C)c2c1[nH]c1ccc(Br)cc12- InChIKey
OSDDZVXUCKZOQA-UHFFFAOYSA-N- Molecular formula
- C17H13BrN2
- Average molar mass
- 325.2 g/mol
- Monoisotopic mass
- 324.02621
Names & identifiers
- Preferred name
- 9-Bromoellipticine
- IUPAC
- 9-bromo-5,11-dimethyl-6H-pyrido[4,3-b]carbazole
- English name
- 9-Bromoellipticine
- Molecular weight
- 0
Names & synonyms
9-Bromoellipticine9-Bromo-5,11-dimethyl-6H-pyrido[4,3-b]carbazoleEllipticine, 9-bromo-18073-34-2CHEMBL194474NSC989279-Bromo-5,11-dimethyl-6H-pyrido(4,3-b)carbazoleNSC-989276H-Pyrido(4,3-b)carbazole, 9-bromo-5,11-dimethyl-6H-Pyrido[4,3-b]carbazole, 9-bromo-5,11-dimethyl-NSC 98927BRN 0543507
Show more names
5-23-09-00418 (Beilstein Handbook Reference)T8T8GG3Y32SCHEMBL27807938SCHEMBL31362096DTXSID80171005BDBM501744096H-Pyrido[4, 9-bromo-5,11-dimethyl-PD183416
Database identifiers
- CAS
18073-34-2- PubChem CID
- 97080
- DTXSID
DTXSID80171005- ChEMBL
CHEMBL194474- UNII
- T8T8GG3Y32
- Nikkaji
- J66.632G
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 374
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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