2-Methylellipticinium
TL;DR: 2-Methylellipticinium (CAS 66604-68-0) is a chemical compound with molecular formula C18H17N2+ and molecular weight 261.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium
Also Known As: 2-Methylellipticinium, 2-Methylellipticine, 2-N-Methylellipticinium, 2,5,11-Trimethyl-6H-pyrido[4,3-b]carbazol-2-ium, Cc1c2cn(C)ccc2c(C)c3Nc4ccccc4c13
| Molecular Formula | C18H17N2+ |
|---|---|
| Molecular Weight | 261.14 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 19.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 261.13916 |
| Heavy Atoms | 20 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 66604-68-0 |
|---|---|
| SMILES | CC1=C2C=C[N+](=CC2=C(C3=C1NC4=CC=CC=C43)C)C |
| InChIKey | VXRLUFPGDHFNHT-UHFFFAOYSA-O |
Product Overview
2-Methylellipticinium (CAS 66604-68-0), with molecular formula C18H17N2+ and molecular weight 261.14 g/mol. IUPAC: 2,5,11-trimethyl-6H-pyrido[4,3-b]carbazol-2-ium.
Chemical Property Profile of 2-Methylellipticinium
Property Insights of 2-Methylellipticinium
The XLogP value of 4.9 indicates that 2-Methylellipticinium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.7 Ų, 2-Methylellipticinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylellipticinium has 1 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-Methylellipticinium?
The CAS number of 2-Methylellipticinium is 66604-68-0.
What is the molecular formula of 2-Methylellipticinium?
The molecular formula of 2-Methylellipticinium is C18H17N2+.
What is the molecular weight of 2-Methylellipticinium?
The molecular weight of 2-Methylellipticinium is 261.14 g/mol.
Where can I buy 2-Methylellipticinium?
You can request a quote for 2-Methylellipticinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylellipticinium?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylellipticinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.