Basic information
- CAS
114259-73-3- Standard SMILES
O=C(O)c1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O- InChIKey
YYIHFZGBMOICLI-UHFFFAOYSA-N- Molecular formula
- C16H11ClN2O3
- Average molar mass
- 314.72 g/mol
- Monoisotopic mass
- 314.0458199
Names & identifiers
- Preferred name
- 5-[(7-Chloroquinolin-4-yl)amino]-2-hydroxybenzoic acid
- IUPAC
- 5-[(7-chloroquinolin-4-yl)amino]-2-hydroxybenzoic acid
Names & synonyms
5-[(7-chloroquinolin-4-yl)amino]-2-hydroxybenzoic acid114259-73-3Benzoic acid, 5-[(7-chloro-4-quinolinyl)amino]-2-hydroxy-5-((7-chloroquinolin-4-yl)amino)-2-hydroxybenzoic acidNSC602119Oprea1_451046SCHEMBL21346921DTXSID60326571STK331891AKOS005439512NSC-602119SR-01000223543
Show more names
SR-01000223543-15-[(7-chloro-4-quinolinyl)amino]-2-hydroxybenzoic acid
Database identifiers
- CAS
114259-73-3- PubChem CID
- 353545
- DTXSID
DTXSID60326571- Nikkaji
- J650.033A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 82.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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