Pannarin
TL;DR: Pannarin (CAS 6340-34-7) is a chemical compound with molecular formula C18H15ClO6 and molecular weight 362.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-chloro-9-hydroxy-3-methoxy-1,4,7-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde
Also Known As: Pannarin, Pannarine, NCI60_015821, 8-chloro-9-hydroxy-3-methoxy-1,4,7-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde, 2-Chloro-3-hydroxy-8-methoxy-1,6,9-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepine-4-carbaldehyde
| Molecular Formula | C18H15ClO6 |
|---|---|
| Molecular Weight | 362.06 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.05573 |
| Heavy Atoms | 25 |
| Complexity | 528.0 |
Chemical Identifiers
| CAS Number | 6340-34-7 |
|---|---|
| SMILES | CC1=CC(=C(C2=C1OC3=C(C(=C(C(=C3C(=O)O2)C)Cl)O)C=O)C)OC |
| InChIKey | LVGKNESDSKGROR-UHFFFAOYSA-N |
Product Overview
Pannarin (CAS 6340-34-7), with molecular formula C18H15ClO6 and molecular weight 362.06 g/mol. IUPAC: 8-chloro-9-hydroxy-3-methoxy-1,4,7-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde.
Chemical Property Profile of Pannarin
Property Insights of Pannarin
The XLogP value of 4.3 indicates that Pannarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Pannarin. Following Lipinski's Rule of Five, Pannarin 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 Pannarin?
The CAS number of Pannarin is 6340-34-7.
What is the molecular formula of Pannarin?
The molecular formula of Pannarin is C18H15ClO6.
What is the molecular weight of Pannarin?
The molecular weight of Pannarin is 362.06 g/mol.
Where can I buy Pannarin?
You can request a quote for Pannarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pannarin?
Yes, KEHONG BIO provides custom synthesis services for Pannarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.