1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione
TL;DR: 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione (CAS 17465-94-0) is a chemical compound with molecular formula C17H12Cl2O3 and molecular weight 334.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-bis(4-chlorophenyl)pentane-1,3,5-trione
Also Known As: 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione, 1,5-bis(4-chlorophenyl)pentane-1,3,5-trione, KST-1B0988, 1,5-Bis -1,3,5-pentanetrione, 1,3,5-Pentanetrione,1,5-bis(4-chlorophenyl)-
| Molecular Formula | C17H12Cl2O3 |
|---|---|
| Molecular Weight | 334.02 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.01636 |
| Heavy Atoms | 22 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 17465-94-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CC(=O)CC(=O)C2=CC=C(C=C2)Cl)Cl |
| InChIKey | JVGXKNGROPICAX-UHFFFAOYSA-N |
Product Overview
1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione (CAS 17465-94-0), with molecular formula C17H12Cl2O3 and molecular weight 334.02 g/mol. IUPAC: 1,5-bis(4-chlorophenyl)pentane-1,3,5-trione.
Chemical Property Profile of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione
Property Insights of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione
The XLogP value of 4.2 indicates that 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione has 0 hydrogen bond donor(s) and 3 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 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione?
The CAS number of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione is 17465-94-0.
What is the molecular formula of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione?
The molecular formula of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione is C17H12Cl2O3.
What is the molecular weight of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione?
The molecular weight of 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione is 334.02 g/mol.
Where can I buy 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione?
You can request a quote for 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Bis(4-chlorophenyl)-1,3,5-pentanetrione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.