Hexamethonium BromideProduct ingredient for Hexamethonium
- Name
- Hexamethonium Bromide
- Drug Entry
- Hexamethonium
A nicotinic cholinergic antagonist often referred to as the prototypical ganglionic blocker. It is poorly absorbed from the gastrointestinal tract and does not cross the blood-brain barrier. It has been used for a variety of therapeutic purposes including hypertension but, like the other ganglionic blockers, it has been replaced by more specific drugs for most purposes, although it is widely used a research tool.
- Accession Number
- DBSALT001082
- Structure
Structure for Hexamethonium Bromide (DBSALT001082)
- Synonyms
- Not Available
- UNII
- 8J77X3S603
- CAS Number
- 55-97-0
- Weight
- Average: 362.194
Monoisotopic: 360.077575 - Chemical Formula
- C12H30Br2N2
- InChI Key
- FAPSXSAPXXJTOU-UHFFFAOYSA-L
- InChI
- InChI=1S/C12H30N2.2BrH/c1-13(2,3)11-9-7-8-10-12-14(4,5)6;;/h7-12H2,1-6H3;2*1H/q+2;;/p-2
- IUPAC Name
- trimethyl[6-(trimethylazaniumyl)hexyl]azanium dibromide
- SMILES
- [Br-].[Br-].C[N+](C)(C)CCCCCC[N+](C)(C)C
- External Links
- ChemSpider
- 5725
- ChEMBL
- CHEMBL332524
- Predicted Properties
Property Value Source Water Solubility 3.86e-05 mg/mL ALOGPS logP -2 ALOGPS logP -6.6 Chemaxon logS -7 ALOGPS Physiological Charge 2 Chemaxon Hydrogen Acceptor Count 0 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 0 Å2 Chemaxon Rotatable Bond Count 7 Chemaxon Refractivity 88.55 m3·mol-1 Chemaxon Polarizability 27.44 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon