9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide
TL;DR: 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide (CAS 63731-84-0) is a chemical compound with molecular formula C20H29Br2N3 and molecular weight 469.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[5-(1-methyl-5H-pyrido[4,3-b]indol-2-ium-2-yl)pentyl]azanium dibromide
Also Known As: IN 216, 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide, Ammonium, (5-(1-methyl-9H-pyrido(3,4-b)indolinio)pentyl)trimethyl-, dibromide, 1-methyl-2-[5-(trimethylammonio)pentyl]-5h-pyrido[4,3-b]indol-2-ium dibromide, 2H-Pyrido[3,4-b]indole-2-pentanaminium, N,N,N,1-tetramethyl-, bromide, monohydrobromide
| Molecular Formula | C20H29Br2N3 |
|---|---|
| Molecular Weight | 469.07 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 19.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 471.07077 |
| Heavy Atoms | 25 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 63731-84-0 |
|---|---|
| SMILES | CC1=[N+](C=CC2=C1C3=CC=CC=C3N2)CCCCC[N+](C)(C)C.[Br-].[Br-] |
| InChIKey | CWJNZABCORLUPT-UHFFFAOYSA-M |
Product Overview
9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide (CAS 63731-84-0), with molecular formula C20H29Br2N3 and molecular weight 469.07 g/mol. IUPAC: trimethyl-[5-(1-methyl-5H-pyrido[4,3-b]indol-2-ium-2-yl)pentyl]azanium dibromide.
Chemical Property Profile of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide
Property Insights of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide
The XLogP value of -2.2 indicates that 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 19.7 Ų, 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide has 1 hydrogen bond donor(s) and 2 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 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide?
The CAS number of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide is 63731-84-0.
What is the molecular formula of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide?
The molecular formula of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide is C20H29Br2N3.
What is the molecular weight of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide?
The molecular weight of 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide is 469.07 g/mol.
Where can I buy 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide?
You can request a quote for 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide?
Yes, KEHONG BIO provides custom synthesis services for 9H-Pyrido(3,4-b)indolium, 1-methyl-2-(5-(trimethylammonio)pentyl)-, dibromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.