Basic information
- CAS
90961-53-8- Standard SMILES
C1CCC2(C1)C1CN(CC3CC3)CC2CN(CC2CC2)C1- InChIKey
CTIRHWCPXYGDGF-UHFFFAOYSA-N- Molecular formula
- C19H32N2
- Average molar mass
- 288.5 g/mol
- Monoisotopic mass
- 288.25654903
Overview
Tedisamil is a member of the class of diazabicyclononanes that is (1s,5s)-3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane] in which the hydrogens at positions 3 and 7 are replaced by cyclopropylmethyl groups. It is a potassium channel blocker and an antiarrhythmic agent currently currently in development for the treatment of atrial fibrillation. It has a role as an anti-arrhythmia drug and a potassium channel blocker. It is a diazabicyclononane, a member of cyclopentanes, an azaspiro compound and a member of cyclopropanes.
Names & identifiers
- Preferred name
- Tedisamil
- IUPAC
- 3,7-bis(cyclopropylmethyl)spiro[3,7-diazabicyclo[3.3.1]nonane-9,1'-cyclopentane]
- English name
- Tedisamil
- Molecular formula
- C19H32N2
- Molecular weight
- 288.47
Names & synonyms
Tedisamil90961-53-8TedisamilumKC-8857KC88573,7-bis(cyclopropylmethyl)spiro[3,7-diazabicyclo[3.3.1]nonane-9,1'-cyclopentane]A5VAY2U3R83',7'-Bis(cyclopropylmethyl)spiro(cyclopentane-1,9'-(3,7)diazabicyclo(3.3.1)nonane)CHEBI:134747DTXSID30238334Spiro(cyclopentane-1,9'-(3,7)diazabicyclo(3.3.1)nonane), 3',7'-bis(cyclopropylmethyl)-3,7-di-(cyclopropylmethyl)-9,9-tetramethylene-3,7-diazabicyclo(3.3.1)nonane
Show more names
Pulzium
3,7-bis(cyclopropylmethyl)-3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane]3,7-bis(cyclopropylmethyl)-3,7-diazaspiro(bicyclo(3.3.1)nonane-9,1'-cyclopentane)3,7-bis(cyclopropylmethyl)spiro(3,7-diazabicyclo(3.3.1)nonane-9,1'-cyclopentane)RefChem:187699C01BD06DTXCID50160825KC 8857Tedisamil (USAN)
Database identifiers
- CAS
90961-53-8- PubChem CID
- 65825
- DTXSID
DTXSID30238334
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 348
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
LogP4.19
Physicochemical properties
- Boiling point
- 372.452 · 372.452±10.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.097 · 1.097±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.218 · 9.218±0.20(predicted)
- FDA UNII
- 5 VAY2U3R8 · A5VAY2U3R8
- ATC code
- 1 BD06 · C01BD06
Chemistry & industry
Pharmacology
ATC Code
C - Cardiovascular system
QC - Cardiovascular system
Mechanism of ActionIt is hypothesized tedisamil prevents Ca2+ overload by the cAMP dependent SR Ca2+ uptake [PMID: 10707827].
MeSH Pharmacological Classification
Agents used for the treatment or prevention of cardiac arrhythmias. They may affect the polarization-repolarization phase of the action potential, its excitability or refractoriness, or impulse conduction or membrane responsiveness within cardiac fibers. Anti-arrhythmia agents are often classed into four main groups according to their mechanism of action: sodium channel blockade, beta-adrenergic blockade, repolarization prolongation, or calcium channel blockade.
Agents that have a strengthening effect on the heart or that can increase cardiac output. They may be CARDIAC GLYCOSIDES; SYMPATHOMIMETICS; or other drugs. They are used after MYOCARDIAL INFARCT; CARDIAC SURGICAL PROCEDURES; in SHOCK; or in congestive heart failure (HEART FAILURE).
Applications
UsesAntiarrhythmic agent (Ktchannel blocker).
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: Tedisamil is a member of the class of diazabicyclononanes that is (1s,5s)-3,7-diazaspiro[bicyclo[3.3.1]nonane-9,1'-cyclopentane] in which the hydrogens at positions 3 and 7 are replaced by cyclopropylmethyl groups. It is a potassium channel blocker and an antiarrhythmic agent currently currently in development for the treatment of atrial fibrillation. It has a role as an anti-arrhythmia drug and a potassium channel blocker. It is an azaspiro compound, a member of cyclopropanes, a member of cyclopentanes and a diazabicyclononane.
Related reactions
2 records
Compound notes
Loading…