Murbetol
TL;DR: Murbetol (CAS 8015-38-1) is a chemical compound with molecular formula C18H23NO7 and molecular weight 365.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid;propan-2-yl N-phenylcarbamate
Also Known As: MURBETOL, Supronal, 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid, disodium salt, mixt. with 1-methylethyl phenylcarbamate, 7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid; propan-2-yl N-phenylcarbamate, 7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid, disodium salt, mixt. with 1-methylethyl phenylcarbamate
| Molecular Formula | C18H23NO7 |
|---|---|
| Molecular Weight | 365.15 g/mol |
| LogP | 2.59 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.14746 |
| Heavy Atoms | 26 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 8015-38-1 |
|---|---|
| SMILES | CC(C)OC(=O)NC1=CC=CC=C1.C1CC2C(C(C1O2)C(=O)O)C(=O)O |
| InChIKey | IFTLLIGQLJEPLL-UHFFFAOYSA-N |
Product Overview
Murbetol (CAS 8015-38-1), with molecular formula C18H23NO7 and molecular weight 365.15 g/mol. IUPAC: 7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid;propan-2-yl N-phenylcarbamate.
Chemical Property Profile of Murbetol
Property Insights of Murbetol
The XLogP value of 2.59 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Murbetol. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Murbetol. Following Lipinski's Rule of Five, Murbetol has 3 hydrogen bond donor(s) and 7 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 Murbetol?
The CAS number of Murbetol is 8015-38-1.
What is the molecular formula of Murbetol?
The molecular formula of Murbetol is C18H23NO7.
What is the molecular weight of Murbetol?
The molecular weight of Murbetol is 365.15 g/mol.
Where can I buy Murbetol?
You can request a quote for Murbetol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Murbetol?
Yes, KEHONG BIO provides custom synthesis services for Murbetol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.