Basic information
- CAS
50503-69-0- Standard SMILES
Cc1ccc2nc(Nc3ccc(Cl)cc3)cc(C(O)C3CCCCN3)c2c1- InChIKey
OPHSUDOCLFJDKP-UHFFFAOYSA-N- Molecular formula
- C22H24ClN3O
- Average molar mass
- 381.9 g/mol
- Monoisotopic mass
- 381.1607901
Names & identifiers
- Preferred name
- (2-((4-Chlorophenyl)amino)-6-methylquinolin-4-yl)(piperidin-2-yl)methanol
- IUPAC
- [2-(4-chloroanilino)-6-methylquinolin-4-yl]-piperidin-2-ylmethanol
Names & synonyms
50503-69-0NSC157571(2-((4-Chlorophenyl)amino)-6-methylquinolin-4-yl)(piperidin-2-yl)methanolSCHEMBL17923198DTXSID40964718NSC-157571[2-(4-chloroanilino)-6-methyl-4-quinolyl]-(2-piperidyl)methanol[2-(4-Chloroanilino)-6-methylquinolin-4-yl](piperidin-2-yl)methanol4-Quinolinemethanol, 2-[(4-chlorophenyl)amino]-6-methyl-.alpha.-2-piperidinyl-
Database identifiers
- CAS
50503-69-0- PubChem CID
- 291978
- DTXSID
DTXSID40964718
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 470
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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