6-Demethylgriseofulvin
TL;DR: 6-Demethylgriseofulvin (CAS 23168-20-9) 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.
7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione
Also Known As: 6-Demethylgriseofulvin, 6-Desmethylgriseofulvin, 6-O-Demethyl Griseofulvin, 7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione, Spiro[benzofuran-2(3H),1'-[2]cyclohexene]-3,4'-dione, 7-chloro-6-hydroxy-2',4-dimethoxy-6'-methyl-, (1'S-trans)-
| Molecular Formula | C16H15ClO6 |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.05573 |
| Heavy Atoms | 23 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 23168-20-9 |
|---|---|
| SMILES | CC1CC(=O)C=C(C12C(=O)C3=C(C=C(C(=C3O2)Cl)O)OC)OC |
| InChIKey | SYNGDIBHUPXIQA-UHFFFAOYSA-N |
Product Overview
6-Demethylgriseofulvin (CAS 23168-20-9), with molecular formula C16H15ClO6 and molecular weight 338.06 g/mol. IUPAC: 7-chloro-6-hydroxy-3',4-dimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione.
Chemical Property Profile of 6-Demethylgriseofulvin
Property Insights of 6-Demethylgriseofulvin
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Demethylgriseofulvin. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Demethylgriseofulvin. Following Lipinski's Rule of Five, 6-Demethylgriseofulvin 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-Demethylgriseofulvin?
The CAS number of 6-Demethylgriseofulvin is 23168-20-9.
What is the molecular formula of 6-Demethylgriseofulvin?
The molecular formula of 6-Demethylgriseofulvin is C16H15ClO6.
What is the molecular weight of 6-Demethylgriseofulvin?
The molecular weight of 6-Demethylgriseofulvin is 338.06 g/mol.
Where can I buy 6-Demethylgriseofulvin?
You can request a quote for 6-Demethylgriseofulvin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Demethylgriseofulvin?
Yes, KEHONG BIO provides custom synthesis services for 6-Demethylgriseofulvin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.