Hernandonine
TL;DR: Hernandonine (CAS 28314-78-5) is a chemical compound with molecular formula C18H9NO5 and molecular weight 319.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.02,10.03,7.016,23.018,22]tricosa-1(23),2(10),3(7),8,12,14,16,18(22)-octaen-11-one
Also Known As: Hernandonine, [?]one, 8H-Bis(1,3)benzodioxolo(6,5,4-de:4',5'-g)quinolin-8-one, 11H-bis[1,3]benzodioxolo[6,5,4-de:4',5'-g]quinolin-11-one, 11H-(1,3)Benzodioxolo(6,5,4-de)-1,3-benzodioxolo(4,5-g)quinolin-11-one
| Molecular Formula | C18H9NO5 |
|---|---|
| Molecular Weight | 319.05 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 319.04807 |
| Heavy Atoms | 24 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 28314-78-5 |
|---|---|
| SMILES | C1OC2=C(O1)C3=C(C=C2)C(=O)C4=NC=CC5=CC6=C(C3=C54)OCO6 |
| InChIKey | QHFWZNALDDSHFJ-UHFFFAOYSA-N |
Product Overview
Hernandonine (CAS 28314-78-5), with molecular formula C18H9NO5 and molecular weight 319.05 g/mol. IUPAC: 4,6,19,21-tetraoxa-13-azahexacyclo[10.10.1.02,10.03,7.016,23.018,22]tricosa-1(23),2(10),3(7),8,12,14,16,18(22)-octaen-11-one.
Chemical Property Profile of Hernandonine
Property Insights of Hernandonine
The XLogP value of 3.2 indicates that Hernandonine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Hernandonine. Following Lipinski's Rule of Five, Hernandonine has 0 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 Hernandonine?
The CAS number of Hernandonine is 28314-78-5.
What is the molecular formula of Hernandonine?
The molecular formula of Hernandonine is C18H9NO5.
What is the molecular weight of Hernandonine?
The molecular weight of Hernandonine is 319.05 g/mol.
Where can I buy Hernandonine?
You can request a quote for Hernandonine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hernandonine?
Yes, KEHONG BIO provides custom synthesis services for Hernandonine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.