Epicorazine A
TL;DR: Epicorazine A (CAS 69176-72-3) is a chemical compound with molecular formula C18H16N2O6S2 and molecular weight 420.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,15-dihydroxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.01,13.03,11.04,9.014,19]docosa-6,16-diene-2,8,12,18-tetrone
Also Known As: Epicorazine A, Epicorazine B, 5,15-dihydroxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.01,13.03,11.04,9.014,19]docosa-6,16-diene-2,8,12,18-tetrone, 4,11-Dihydroxy-4,4a,7,7a,11,11a,14,14a-octahydro-1H,6H,8H,13H-6a,13a-epidithiopyrazino[1,2-a:4,5-a']diindole-1,6,8,13-tetrone, 8H,13H-6a,13a-Epidithio-1H,6H-pyrazino(1,2-a:4,5-a')diindole-1,6,8,13-tetrone, 4,4a,7,7a,11,11a,14,14a-octahydro-4,11-dihydroxy-, (4S-(4alpha,4aalpha,6abeta,7aalpha,11alpha,11aalpha,13abeta,14abeta))-
| Molecular Formula | C18H16N2O6S2 |
|---|---|
| Molecular Weight | 420.04 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 420.04498 |
| Heavy Atoms | 28 |
| Complexity | 861.0 |
Chemical Identifiers
| CAS Number | 69176-72-3 |
|---|---|
| SMILES | C1C2C(C(C=CC2=O)O)N3C14C(=O)N5C6C(CC5(C3=O)SS4)C(=O)C=CC6O |
| InChIKey | RCODXLGTKJXDNC-UHFFFAOYSA-N |
Product Overview
Epicorazine A (CAS 69176-72-3), with molecular formula C18H16N2O6S2 and molecular weight 420.04 g/mol. IUPAC: 5,15-dihydroxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.01,13.03,11.04,9.014,19]docosa-6,16-diene-2,8,12,18-tetrone.
Chemical Property Profile of Epicorazine A
Property Insights of Epicorazine A
The XLogP value of -1.7 indicates that Epicorazine A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 166.0 Ų indicates high polarity, suggesting Epicorazine A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epicorazine A has 2 hydrogen bond donor(s) and 8 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 Epicorazine A?
The CAS number of Epicorazine A is 69176-72-3.
What is the molecular formula of Epicorazine A?
The molecular formula of Epicorazine A is C18H16N2O6S2.
What is the molecular weight of Epicorazine A?
The molecular weight of Epicorazine A is 420.04 g/mol.
Where can I buy Epicorazine A?
You can request a quote for Epicorazine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epicorazine A?
Yes, KEHONG BIO provides custom synthesis services for Epicorazine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.