Basic information
- Standard SMILES
O=S(=O)(O)c1ccc(Nc2ccnc3cc(Cl)ccc23)cc1Cl- InChIKey
JZNBVYGUXPGGTH-UHFFFAOYSA-N- Molecular formula
- C15H10Cl2N2O3S
- Average molar mass
- 369.2 g/mol
Names & identifiers
- Preferred name
- 4-(7-Chloro-4-quinolylamino)-2-chlorobenzenesulphonic acid
- IUPAC
- 2-chloro-4-[(7-chloroquinolin-4-yl)amino]benzenesulfonic acid
Names & synonyms
SCHEMBL11815016JZNBVYGUXPGGTH-UHFFFAOYSA-N4-(7-chloro-4-quinolylamino)-2-chlorobenzenesulphonic acid
Database identifiers
- PubChem CID
- 21563544
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 513
Related reactions
2 records
Compound notes
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