Bisdechlorogeodin
TL;DR: Bisdechlorogeodin (CAS 59092-96-5) is a chemical compound with molecular formula C17H14O7 and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-hydroxy-5'-methoxy-6-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate
Also Known As: Bisdechlorogeodin, Bis-dechlorogeodin, Dechlorogeodin, Geodin, Antibiotic C3368-A
| Molecular Formula | C17H14O7 |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.07394 |
| Heavy Atoms | 24 |
| Complexity | 662.0 |
Chemical Identifiers
| CAS Number | 59092-96-5 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)OC3(C2=O)C(=CC(=O)C=C3OC)C(=O)OC)O |
| InChIKey | JCMPRFCVZKOFIT-UHFFFAOYSA-N |
Product Overview
Bisdechlorogeodin (CAS 59092-96-5), with molecular formula C17H14O7 and molecular weight 330.07 g/mol. IUPAC: methyl 4-hydroxy-5'-methoxy-6-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate.
Chemical Property Profile of Bisdechlorogeodin
Property Insights of Bisdechlorogeodin
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bisdechlorogeodin. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Bisdechlorogeodin. Following Lipinski's Rule of Five, Bisdechlorogeodin has 1 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 Bisdechlorogeodin?
The CAS number of Bisdechlorogeodin is 59092-96-5.
What is the molecular formula of Bisdechlorogeodin?
The molecular formula of Bisdechlorogeodin is C17H14O7.
What is the molecular weight of Bisdechlorogeodin?
The molecular weight of Bisdechlorogeodin is 330.07 g/mol.
Where can I buy Bisdechlorogeodin?
You can request a quote for Bisdechlorogeodin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bisdechlorogeodin?
Yes, KEHONG BIO provides custom synthesis services for Bisdechlorogeodin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.