D132-0046
TL;DR: D132-0046 (CAS 898921-08-9) is a chemical compound with molecular formula C26H21FO6 and molecular weight 448.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(3,4-dimethoxyphenyl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-fluorobenzoate
Also Known As: D132-0046, 6-(3,4-dimethoxyphenyl)-1,3-dimethyl-4-oxo-4H-cyclohepta[c]furan-8-yl 4-fluorobenzoate, [6-(3,4-dimethoxyphenyl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-fluorobenzoate
| Molecular Formula | C26H21FO6 |
|---|---|
| Molecular Weight | 448.13 g/mol |
| LogP | 5.45234 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.1322 |
| Heavy Atoms | 33 |
| Complexity | 1419.9094 |
Chemical Identifiers
| CAS Number | 898921-08-9 |
|---|---|
| SMILES | CC1=C2C(=CC(=CC(=O)C2=C(O1)C)C3=CC(=C(C=C3)OC)OC)OC(=O)C4=CC=C(C=C4)F |
Product Overview
D132-0046 (CAS 898921-08-9), with molecular formula C26H21FO6 and molecular weight 448.13 g/mol. IUPAC: [6-(3,4-dimethoxyphenyl)-1,3-dimethyl-8-oxocyclohepta[c]furan-4-yl] 4-fluorobenzoate.
Chemical Property Profile of D132-0046
Property Insights of D132-0046
The XLogP value of 5.45234 indicates that D132-0046 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for D132-0046. Following Lipinski's Rule of Five, D132-0046 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D132-0046?
The CAS number of D132-0046 is 898921-08-9.
What is the molecular formula of D132-0046?
The molecular formula of D132-0046 is C26H21FO6.
What is the molecular weight of D132-0046?
The molecular weight of D132-0046 is 448.13 g/mol.
Where can I buy D132-0046?
You can request a quote for D132-0046 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D132-0046?
Yes, KEHONG BIO provides custom synthesis services for D132-0046 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.