Chelilutine
TL;DR: Chelilutine (CAS 55950-32-8) is a chemical compound with molecular formula C22H20NO5+ and molecular weight 378.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,4-trimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium
Also Known As: Chelilutine, cheliluttine, 1,2,4-trimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium, [1,3]benzodioxolo[5,6-c]phenanthridinium, 1,2,4-trimethoxy-12-methyl-, 1,2,4-trimethoxy-12-methyl-(1,3)benzodioxolo(5,6-c)phenanthridin-12-ium
| Molecular Formula | C22H20NO5+ |
|---|---|
| Molecular Weight | 378.13 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 50.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 378.13416 |
| Heavy Atoms | 28 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 55950-32-8 |
|---|---|
| SMILES | C[N+]1=C2C(=C3C(=CC(=C(C3=C1)OC)OC)OC)C=CC4=CC5=C(C=C42)OCO5 |
| InChIKey | LZJHNXHYKRKCDZ-UHFFFAOYSA-N |
Product Overview
Chelilutine (CAS 55950-32-8), with molecular formula C22H20NO5+ and molecular weight 378.13 g/mol. IUPAC: 1,2,4-trimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium.
Chemical Property Profile of Chelilutine
Property Insights of Chelilutine
The XLogP value of 4.5 indicates that Chelilutine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.0 Ų, Chelilutine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chelilutine has 0 hydrogen bond donor(s) and 5 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 Chelilutine?
The CAS number of Chelilutine is 55950-32-8.
What is the molecular formula of Chelilutine?
The molecular formula of Chelilutine is C22H20NO5+.
What is the molecular weight of Chelilutine?
The molecular weight of Chelilutine is 378.13 g/mol.
Where can I buy Chelilutine?
You can request a quote for Chelilutine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chelilutine?
Yes, KEHONG BIO provides custom synthesis services for Chelilutine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.