Basic information
- Standard SMILES
CN(C)C1CCN(S(=O)(=O)c2ccc(Nc3ccnc4cc(Cl)ccc34)cc2)CC1- InChIKey
HRLRMMPYQPVJEY-UHFFFAOYSA-N- Molecular formula
- C22H25ClN4O2S
- Average molar mass
- 445 g/mol
Names & identifiers
- Preferred name
- 4-Dimethylamino-1-[4-(7-chloro-4-quinolylamino)-benzenesulphonyl]piperidine
- IUPAC
- 7-chloro-N-[4-[4-(dimethylamino)piperidin-1-yl]sulfonylphenyl]quinolin-4-amine
Names & synonyms
SCHEMBL11809301HRLRMMPYQPVJEY-UHFFFAOYSA-N4-Dimethylamino-1-[4-(7-chloro-4-quinolylamino)-benzenesulphonyl]piperidine
Database identifiers
- PubChem CID
- 21563545
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 73.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 655
Related reactions
2 records
Compound notes
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