Methoxymecambridine
TL;DR: Methoxymecambridine (CAS 104683-31-0) is a chemical compound with molecular formula C23H27NO7 and molecular weight 429.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,9,17,18-tetramethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2(10),3,8,15,17,19-hexaen-19-yl)methanol
Also Known As: Methoxymecambridine, 1-Acetyl-7-jod-indolin, 5,8,13,13a-Tetrahydro-4,10,11,14(or 5,10,11,14)-tetramethoxy-6H-benzo(g)-1,3-benzodioxolo(5,6-a)quinolizine-12-methanol, (3,9,17,18-tetramethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2(10),3,8,15,17,19-hexaen-19-yl)methanol, (4,10,11,14-Tetramethoxy-5,8,13,13a-tetrahydro-2H,6H-[1,3]dioxolo[4,5-g]isoquinolino[3,2-a]isoquinolin-12-yl)methanol
| Molecular Formula | C23H27NO7 |
|---|---|
| Molecular Weight | 429.18 g/mol |
| LogP | 2.5975 |
| Topological Polar Surface Area | 78.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.17874 |
| Heavy Atoms | 31 |
| Complexity | 1035.8058 |
Chemical Identifiers
| CAS Number | 104683-31-0 |
|---|---|
| SMILES | COC1=C(C(=C2CC3C4=C(CCN3CC2=C1)C(=C5C(=C4OC)OCO5)OC)CO)OC |
Product Overview
Methoxymecambridine (CAS 104683-31-0), with molecular formula C23H27NO7 and molecular weight 429.18 g/mol. IUPAC: (3,9,17,18-tetramethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2(10),3,8,15,17,19-hexaen-19-yl)methanol.
Chemical Property Profile of Methoxymecambridine
Property Insights of Methoxymecambridine
The XLogP value of 2.5975 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methoxymecambridine. The TPSA of 78.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Methoxymecambridine. Following Lipinski's Rule of Five, Methoxymecambridine has 1 hydrogen bond donor(s) and 8 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 Methoxymecambridine?
The CAS number of Methoxymecambridine is 104683-31-0.
What is the molecular formula of Methoxymecambridine?
The molecular formula of Methoxymecambridine is C23H27NO7.
What is the molecular weight of Methoxymecambridine?
The molecular weight of Methoxymecambridine is 429.18 g/mol.
Where can I buy Methoxymecambridine?
You can request a quote for Methoxymecambridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methoxymecambridine?
Yes, KEHONG BIO provides custom synthesis services for Methoxymecambridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.