Basic information
- CAS
314077-06-0- Standard SMILES
O=C(N/N=C/C(Br)=C/c1ccccc1)c1cc(-c2ccccc2)nc2ccccc12- InChIKey
HUHHXMFAMNQNMQ-HCLFYSKESA-N- Molecular formula
- C25H18BrN3O
- Average molar mass
- 456.3 g/mol
- Monoisotopic mass
- 455.06332
Names & identifiers
- Preferred name
- 2-Phenyl-quinoline-4-carboxylic acid (2-bromo-3-phenyl-allylidene)-hydrazide
- IUPAC
- N-[(E)-[(Z)-2-bromo-3-phenylprop-2-enylidene]amino]-2-phenylquinoline-4-carboxamide
- English name
- 2-Phenyl-quinoline-4-carboxylic acid (2-bromo-3-phenyl-allylidene)-hydrazide
- Molecular weight
- 0
Names & synonyms
AKOS002177788ST500632382-PHENYL-QUINOLINE-4-CARBOXYLIC ACID (2-BROMO-3-PHENYL-ALLYLIDENE)-HYDRAZIDEN-((3Z,1E)-3-bromo-4-phenyl-1-azabuta-1,3-dienyl)(2-phenyl(4-quinolyl))carboxa mide
Database identifiers
- CAS
314077-06-0- PubChem CID
- 9670751
- EC Number
- 157-596-1
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 622
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMA ALDRICH IRELAND LTD[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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