Basic information
- CAS
86024-64-8- Standard SMILES
CC(C)(C)c1cc(C(O)CCC2CCNCC2)c2ccccc2n1- InChIKey
OPNPUTUBENWDBA-UHFFFAOYSA-N- Molecular formula
- C21H30N2O
- Average molar mass
- 326.5 g/mol
- Monoisotopic mass
- 326.23581359
Names & identifiers
- Preferred name
- Quinacainol
- IUPAC
- 1-(2-tert-butylquinolin-4-yl)-3-piperidin-4-ylpropan-1-ol
- English name
- quinacainol
- Molecular formula
- C21H30N2O
- Molecular weight
- 326.48
Names & synonyms
QUINACAINOLQuinacainolum86024-64-85OX8977NGOPK-101391-(4-(2-tert-Butylquinolyl))-3-(4-piperidyl)propanol4-Quinolinemethanol, 2-(1,1-dimethylethyl)-alpha-(2-(4-piperidinyl)ethyl)-RP-54272RefChem:17815086073-85-0Quinacainol [INN]UNII-5OX8977NGO
Show more names
54272RP2-(1,1-Dimethylethyl)-α-[2-(4-piperidinyl)ethyl]-4-quinolinemethanol4-Quinolinemethanol, 2-(1,1-dimethylethyl)-α-[2-(4-piperidinyl)ethyl]-
1-(2-tert-butylquinolin-4-yl)-3-piperidin-4-ylpropan-1-ol(+-)-2-tert-Butyl-alpha-(2-(4-piperidyl)ethyl)-4-chinolinmethanol(+-)-2-tert-Butyl-alpha-(2-(4-piperidyl)ethyl)-4-quinolinemethanolPK 10139;PK 10139;PK 10139PK 10139RP 54272orb1701749SCHEMBL1815377
Database identifiers
- CAS
86024-64-8、86073-85-0- PubChem CID
- 55464
- DTXSID
DTXSID60868946- ChEMBL
CHEMBL2107029- UNII
- 5OX8977NGO
- Nikkaji
- J22.963F
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 386
Chemistry & industry
Applications
DescriptionQuinacainol is a Class I antiarrhythmic drug.
UsesQuinacainol (PK 10139) is an inhibitor for sodium current with an EC50 of 95 μM. Quinacainol exhibits antiarrhythmic activity by affecting the electrophysiological properties of the heart[1].
Suppliers1 total
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
Related reactions
2 records
Compound notes
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