Ici 53072
TL;DR: Ici 53072 (CAS 23145-69-9) is a chemical compound with molecular formula C19H22O3 and molecular weight 298.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]propanoic acid
Also Known As: 3-Pyridinesulfonamide, Ici 53072, 2-methyl-2-[4-(1-methyl-1-phenylethyl)phenoxy]propanoic acid, 2-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]propanoic acid, propanoic acid, 2-methyl-2-[4-(1-methyl-1-phenylethyl)phenoxy]-
| Molecular Formula | C19H22O3 |
|---|---|
| Molecular Weight | 298.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.1569 |
| Heavy Atoms | 22 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 23145-69-9 |
|---|---|
| SMILES | CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)OC(C)(C)C(=O)O |
| InChIKey | MGQNICQOOANLCD-UHFFFAOYSA-N |
Product Overview
Ici 53072 (CAS 23145-69-9), with molecular formula C19H22O3 and molecular weight 298.16 g/mol. IUPAC: 2-methyl-2-[4-(2-phenylpropan-2-yl)phenoxy]propanoic acid.
Chemical Property Profile of Ici 53072
Property Insights of Ici 53072
The XLogP value of 4.7 indicates that Ici 53072 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Ici 53072 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ici 53072 has 1 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 Ici 53072?
The CAS number of Ici 53072 is 23145-69-9.
What is the molecular formula of Ici 53072?
The molecular formula of Ici 53072 is C19H22O3.
What is the molecular weight of Ici 53072?
The molecular weight of Ici 53072 is 298.16 g/mol.
Where can I buy Ici 53072?
You can request a quote for Ici 53072 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 53072?
Yes, KEHONG BIO provides custom synthesis services for Ici 53072 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.