A3440/0146009
TL;DR: A3440/0146009 (CAS 696613-75-9) is a chemical compound with molecular formula C25H30O7 and molecular weight 442.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[1-(3,4-dimethoxyphenyl)-3-(2,4-dimethylphenyl)-2-methyl-3-oxopropyl]propanedioate
Also Known As: A3440/0146009, dimethyl 2-(1-(3,4-dimethoxyphenyl)-3-(2,4-dimethylphenyl)-2-methyl-3-oxopropyl)malonate, dimethyl [1-(3,4-dimethoxyphenyl)-3-(2,4-dimethylphenyl)-2-methyl-3-oxopropyl]propanedioate, dimethyl 2-[1-(3,4-dimethoxyphenyl)-3-(2,4-dimethylphenyl)-2-methyl-3-oxopropyl]propanedioate
| Molecular Formula | C25H30O7 |
|---|---|
| Molecular Weight | 442.20 g/mol |
| LogP | 3.88544 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 442.19916 |
| Heavy Atoms | 32 |
| Complexity | 979.7801 |
Chemical Identifiers
| CAS Number | 696613-75-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)C(C)C(C2=CC(=C(C=C2)OC)OC)C(C(=O)OC)C(=O)OC)C |
Product Overview
A3440/0146009 (CAS 696613-75-9), with molecular formula C25H30O7 and molecular weight 442.20 g/mol. IUPAC: dimethyl 2-[1-(3,4-dimethoxyphenyl)-3-(2,4-dimethylphenyl)-2-methyl-3-oxopropyl]propanedioate.
Chemical Property Profile of A3440/0146009
Property Insights of A3440/0146009
The XLogP value of 3.88544 indicates that A3440/0146009 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.13 Ų falls within the moderate polarity range, balancing permeability and solubility for A3440/0146009. Following Lipinski's Rule of Five, A3440/0146009 has 0 hydrogen bond donor(s) and 7 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 A3440/0146009?
The CAS number of A3440/0146009 is 696613-75-9.
What is the molecular formula of A3440/0146009?
The molecular formula of A3440/0146009 is C25H30O7.
What is the molecular weight of A3440/0146009?
The molecular weight of A3440/0146009 is 442.20 g/mol.
Where can I buy A3440/0146009?
You can request a quote for A3440/0146009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3440/0146009?
Yes, KEHONG BIO provides custom synthesis services for A3440/0146009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.