Hernandalinol
TL;DR: Hernandalinol (CAS 62874-90-2) is a chemical compound with molecular formula C29H33NO7 and molecular weight 507.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy]-4,5-dimethoxyphenyl]methanol
Also Known As: Hernandalinol, [2-[[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy]-4,5-dimethoxyphenyl]methanol, (4,5-Dimethoxy-2-{[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy}phenyl)methanol, Benzenemethanol, 4,5-dimethoxy-2-((5,6,6a,7-tetrahydro-1,2,10-trimethoxy-6-methyl-4H-dibenzo(de,g)quinolin-9-yl)oxy)-, (S)-, RefChem:145804
| Molecular Formula | C29H33NO7 |
|---|---|
| Molecular Weight | 507.23 g/mol |
| LogP | 4.7663 |
| Topological Polar Surface Area | 78.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 507.2257 |
| Heavy Atoms | 37 |
| Complexity | 1336.806 |
Chemical Identifiers
| CAS Number | 62874-90-2 |
|---|---|
| SMILES | CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)OC5=CC(=C(C=C5CO)OC)OC)OC)OC |
Product Overview
Hernandalinol (CAS 62874-90-2), with molecular formula C29H33NO7 and molecular weight 507.23 g/mol. IUPAC: [2-[[(6aS)-1,2,10-trimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-9-yl]oxy]-4,5-dimethoxyphenyl]methanol.
Chemical Property Profile of Hernandalinol
Property Insights of Hernandalinol
The XLogP value of 4.7663 indicates that Hernandalinol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.85 Ų falls within the moderate polarity range, balancing permeability and solubility for Hernandalinol. Following Lipinski's Rule of Five, Hernandalinol has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hernandalinol?
The CAS number of Hernandalinol is 62874-90-2.
What is the molecular formula of Hernandalinol?
The molecular formula of Hernandalinol is C29H33NO7.
What is the molecular weight of Hernandalinol?
The molecular weight of Hernandalinol is 507.23 g/mol.
Where can I buy Hernandalinol?
You can request a quote for Hernandalinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hernandalinol?
Yes, KEHONG BIO provides custom synthesis services for Hernandalinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.