6-O-Demethyl Griseofulvin
TL;DR: 6-O-Demethyl Griseofulvin (CAS 20168-89-2) is a chemical compound with molecular formula C16H15ClO6 and molecular weight 338.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione
Also Known As: 6-O-Demethyl Griseofulvin, 6-Demethylgriseofulvin, 6-Desmethylgriseofulvin, 6-Desmethyl-griseofulvin, 6-O-Demethylgriseofulvin
| Molecular Formula | C16H15ClO6 |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 2.5073 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.05573 |
| Heavy Atoms | 23 |
| Complexity | 753.4276 |
Chemical Identifiers
| CAS Number | 20168-89-2 |
|---|---|
| SMILES | C[C@@H]1CC(=O)C=C([C@]12C(=O)C3=C(C=C(C(=C3O2)Cl)O)OC)OC |
Product Overview
6-O-Demethyl Griseofulvin (CAS 20168-89-2), with molecular formula C16H15ClO6 and molecular weight 338.06 g/mol. IUPAC: (2S,5'R)-7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione.
Chemical Property Profile of 6-O-Demethyl Griseofulvin
Property Insights of 6-O-Demethyl Griseofulvin
The XLogP value of 2.5073 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-O-Demethyl Griseofulvin. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-O-Demethyl Griseofulvin. Following Lipinski's Rule of Five, 6-O-Demethyl Griseofulvin has 1 hydrogen bond donor(s) and 6 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 6-O-Demethyl Griseofulvin?
The CAS number of 6-O-Demethyl Griseofulvin is 20168-89-2.
What is the molecular formula of 6-O-Demethyl Griseofulvin?
The molecular formula of 6-O-Demethyl Griseofulvin is C16H15ClO6.
What is the molecular weight of 6-O-Demethyl Griseofulvin?
The molecular weight of 6-O-Demethyl Griseofulvin is 338.06 g/mol.
Where can I buy 6-O-Demethyl Griseofulvin?
You can request a quote for 6-O-Demethyl Griseofulvin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-O-Demethyl Griseofulvin?
Yes, KEHONG BIO provides custom synthesis services for 6-O-Demethyl Griseofulvin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.