Cercosporamide
TL;DR: Cercosporamide (CAS 131436-22-1) is a chemical compound with molecular formula C16H13NO7 and molecular weight 331.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9aS)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxodibenzofuran-4-carboxamide
Also Known As: Cercosporamide, (-)-Cercosporamide, 4-Dibenzofurancarboxamide, (9aS)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxodibenzofuran-4-carboxamide, J2.817.551E
| Molecular Formula | C16H13NO7 |
|---|---|
| Molecular Weight | 331.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 331.0692 |
| Heavy Atoms | 24 |
| Complexity | 709.0 |
Chemical Identifiers
| CAS Number | 131436-22-1 |
|---|---|
| SMILES | CC(=O)C1=C(C=C2[C@@](C1=O)(C3=C(C=C(C(=C3O2)C(=O)N)O)O)C)O |
| InChIKey | GEWLYFZWVLXQME-MRXNPFEDSA-N |
Product Overview
Cercosporamide (CAS 131436-22-1), with molecular formula C16H13NO7 and molecular weight 331.07 g/mol. IUPAC: (9aS)-8-acetyl-1,3,7-trihydroxy-9a-methyl-9-oxodibenzofuran-4-carboxamide.
Chemical Property Profile of Cercosporamide
Property Insights of Cercosporamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cercosporamide. The TPSA of 147.0 Ų indicates high polarity, suggesting Cercosporamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cercosporamide has 4 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 Cercosporamide?
The CAS number of Cercosporamide is 131436-22-1.
What is the molecular formula of Cercosporamide?
The molecular formula of Cercosporamide is C16H13NO7.
What is the molecular weight of Cercosporamide?
The molecular weight of Cercosporamide is 331.07 g/mol.
Where can I buy Cercosporamide?
You can request a quote for Cercosporamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cercosporamide?
Yes, KEHONG BIO provides custom synthesis services for Cercosporamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.