2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide
TL;DR: 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide (CAS 71731-46-9) is a chemical compound with molecular formula C23H28BrN and molecular weight 397.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-benzhydrylidene-5-methyl-1,2,3,4,6,7,9,9a-octahydroquinolizin-5-ium bromide
Also Known As: trans-2-(Diphenylmethylene)octahydro-5-methyl-2H-quinolizinium bromide, 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide, 2H-Quinolizinium,octahydro-2- -5-methyl-,bromide,trans-, 2H-Quinolizinium, octahydro-2-(diphenylmethylene)-5-methyl-, bromide, trans-, 8-benzhydrylidene-5-methyl-1,2,3,4,6,7,9,9a-octahydroquinolizin-5-ium bromide
| Molecular Formula | C23H28BrN |
|---|---|
| Molecular Weight | 397.14 g/mol |
| LogP | 2.2854 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 397.1405 |
| Heavy Atoms | 25 |
| Complexity | 680.7727 |
Chemical Identifiers
| CAS Number | 71731-46-9 |
|---|---|
| SMILES | C[N+]12CCCCC1CC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2.[Br-] |
Product Overview
2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide (CAS 71731-46-9), with molecular formula C23H28BrN and molecular weight 397.14 g/mol. IUPAC: 8-benzhydrylidene-5-methyl-1,2,3,4,6,7,9,9a-octahydroquinolizin-5-ium bromide.
Chemical Property Profile of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide
Property Insights of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide
The XLogP value of 2.2854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide. With a topological polar surface area (TPSA) of 0.0 Ų, 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide?
The CAS number of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide is 71731-46-9.
What is the molecular formula of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide?
The molecular formula of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide is C23H28BrN.
What is the molecular weight of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide?
The molecular weight of 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide is 397.14 g/mol.
Where can I buy 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide?
You can request a quote for 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diphenylmethylidene)-5-methyloctahydro-2H-quinolizin-5-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.