1-[(5,8-Dichloroquinolin-4-yl)amino]-3-(diethylamino)propan-2-ol
Basic information
- CAS
5431-51-6- Standard SMILES
CCN(CC)CC(O)CNc1ccnc2c(Cl)ccc(Cl)c12- InChIKey
BZWHSBUIROLLNN-UHFFFAOYSA-N- Molecular formula
- C16H21Cl2N3O
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 341.1061677
Names & identifiers
- Preferred name
- 1-[(5,8-Dichloroquinolin-4-yl)amino]-3-(diethylamino)propan-2-ol
- IUPAC
- 1-[(5,8-dichloroquinolin-4-yl)amino]-3-(diethylamino)propan-2-ol
Names & synonyms
5431-51-6MLS0026383301-[(5,8-dichloroquinolin-4-yl)amino]-3-(diethylamino)propan-2-olNSC13592CHEMBL1704240DTXSID60279654HMS3086L19NSC-13592SMR001547816DS-0085191-[(5,8-dichloroquinolin-4-yl)amino]-3-diethylamino-propan-2-ol
Database identifiers
- CAS
5431-51-6- PubChem CID
- 224802
- DTXSID
DTXSID60279654- ChEMBL
CHEMBL1704240
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 331
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Compound notes
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