Basic information
- CAS
332381-29-0- Standard SMILES
COc1ccc(-c2cc(C(=O)Oc3ccc(Br)cc3)c3ccccc3n2)cc1- InChIKey
VAOCHZNTURYVNX-UHFFFAOYSA-N- Molecular formula
- C23H16BrNO3
- Average molar mass
- 434.3 g/mol
- Monoisotopic mass
- 433.03136
Names & identifiers
- Preferred name
- 4-Bromophenyl 2-(4-methoxyphenyl)quinoline-4-carboxylate
- IUPAC
- (4-bromophenyl) 2-(4-methoxyphenyl)quinoline-4-carboxylate
- English name
- 4-bromophenyl 2-(4-methoxyphenyl)-4-quinolinecarboxylate
- Molecular formula
- C23H16BrNO3
- Molecular weight
- 434.28
Names & synonyms
4-bromophenyl 2-(4-methoxyphenyl)quinoline-4-carboxylate332381-29-0(4-bromophenyl) 2-(4-methoxyphenyl)quinoline-4-carboxylateC23H16BrNO3Oprea1_165460Oprea1_206914CHEMBL1610097HMS1799K122-(4-Methoxy-phenyl)-quinoline-4-carboxylic acid 4-bromo-phenyl esterSTK269967AKOS000577507SB73185
Show more names
4-Quinolinecarboxylic acid, 2-(4-methoxyphenyl)-, 4-bromophenyl ester
NCGC00099681-01CS-0332889ST50253453AG-690/40749321SR-01000494596SR-01000494596-14-bromophenyl 2-(4-methoxyphenyl)-4-quinolinecarboxylate4-bromophenyl2-(4-methoxyphenyl)quinoline-4-carboxylate
Database identifiers
- CAS
332381-29-0- PubChem CID
- 1734587
- ChEMBL
CHEMBL1610097
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 514
Chemistry & industry
Suppliers2 total
Interbioscreen Ltd.[email protected]
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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