LY 213024
TL;DR: LY 213024 (CAS 136954-22-8) is a chemical compound with molecular formula C27H34O6 and molecular weight 454.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(2-carboxyethyl)-4-decoxybenzoyl]benzoic acid
Also Known As: LTB4 antagonist 4, 3-[3-(2-carboxyethyl)-4-decoxybenzoyl]benzoic acid, Benzenepropanoic acid, 5-(3-carboxybenzoyl)-2-(decyloxy)-, 3'-Carboxy-4-decyloxybenzophenone-3-propanoic acid, 3-[3-(2-carboxyethyl)-4-(decyloxy)benzoyl]benzoic acid
| Molecular Formula | C27H34O6 |
|---|---|
| Molecular Weight | 454.24 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 16 |
| Exact Mass | 454.23553 |
| Heavy Atoms | 33 |
| Complexity | 603.0 |
Chemical Identifiers
| CAS Number | 136954-22-8 |
|---|---|
| SMILES | CCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)O)CCC(=O)O |
| InChIKey | CMMZAOHHIRUNGK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
LY 213024 (CAS 136954-22-8), with molecular formula C27H34O6 and molecular weight 454.24 g/mol. IUPAC: 3-[3-(2-carboxyethyl)-4-decoxybenzoyl]benzoic acid.
Chemical Property Profile of LY 213024
Property Insights of LY 213024
The XLogP value of 7.0 indicates that LY 213024 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for LY 213024. Following Lipinski's Rule of Five, LY 213024 has 2 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 LY 213024?
The CAS number of LY 213024 is 136954-22-8.
What is the molecular formula of LY 213024?
The molecular formula of LY 213024 is C27H34O6.
What is the molecular weight of LY 213024?
The molecular weight of LY 213024 is 454.24 g/mol.
Where can I buy LY 213024?
You can request a quote for LY 213024 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for LY 213024?
Yes, KEHONG BIO provides custom synthesis services for LY 213024 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.