AQ-149/41675232
TL;DR: AQ-149/41675232 (CAS 1005106-18-2) is a chemical compound with molecular formula C27H40O6 and molecular weight 460.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methylpropyl) 2-(4-tert-butylphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Also Known As: AQ-149/41675232, bis(2-methylpropyl) 2-(4-tert-butylphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate, A3243/0137746, diisobutyl 2-(4-(tert-butyl)phenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate, diisobutyl 2-(4-tert-butylphenyl)-4-hydroxy-4-methyl-6-oxo-1,3-cyclohexanedicarboxylate
| Molecular Formula | C27H40O6 |
|---|---|
| Molecular Weight | 460.28 g/mol |
| LogP | 4.4223 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.2825 |
| Heavy Atoms | 33 |
| Complexity | 844.3577 |
Chemical Identifiers
| CAS Number | 1005106-18-2 |
|---|---|
| SMILES | CC(C)COC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC(C)C)C2=CC=C(C=C2)C(C)(C)C |
Product Overview
AQ-149/41675232 (CAS 1005106-18-2), with molecular formula C27H40O6 and molecular weight 460.28 g/mol. IUPAC: bis(2-methylpropyl) 2-(4-tert-butylphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate.
Chemical Property Profile of AQ-149/41675232
Property Insights of AQ-149/41675232
The XLogP value of 4.4223 indicates that AQ-149/41675232 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for AQ-149/41675232. Following Lipinski's Rule of Five, AQ-149/41675232 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 AQ-149/41675232?
The CAS number of AQ-149/41675232 is 1005106-18-2.
What is the molecular formula of AQ-149/41675232?
The molecular formula of AQ-149/41675232 is C27H40O6.
What is the molecular weight of AQ-149/41675232?
The molecular weight of AQ-149/41675232 is 460.28 g/mol.
Where can I buy AQ-149/41675232?
You can request a quote for AQ-149/41675232 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AQ-149/41675232?
Yes, KEHONG BIO provides custom synthesis services for AQ-149/41675232 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.