![Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate structure](/static/products/4332/433253-71-5.webp)
Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate
TL;DR: Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate (CAS 433253-71-5) is a chemical compound with molecular formula C22H27NO4 and molecular weight 369.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 3-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]benzoate
Also Known As: AE-641/40790929, propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate, propyl 3-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]benzoate, propyl 3-(2-(2-isopropyl-5-methylphenoxy)acetamido)benzoate, propyl 3-{2-[5-methyl-2-(methylethyl)phenoxy]acetylamino}benzoate
| Molecular Formula | C22H27NO4 |
|---|---|
| Molecular Weight | 369.19 g/mol |
| LogP | 4.70272 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 369.194 |
| Heavy Atoms | 27 |
| Complexity | 798.64984 |
Chemical Identifiers
| CAS Number | 433253-71-5 |
|---|---|
| SMILES | CCCOC(=O)C1=CC(=CC=C1)NC(=O)COC2=C(C=CC(=C2)C)C(C)C |
Product Overview
Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate (CAS 433253-71-5), with molecular formula C22H27NO4 and molecular weight 369.19 g/mol. IUPAC: propyl 3-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]benzoate.
Chemical Property Profile of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate
Property Insights of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate
The XLogP value of 4.70272 indicates that Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate. Following Lipinski's Rule of Five, Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate has 1 hydrogen bond donor(s) and 4 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 Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate?
The CAS number of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate is 433253-71-5.
What is the molecular formula of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate?
The molecular formula of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate is C22H27NO4.
What is the molecular weight of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate?
The molecular weight of Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate is 369.19 g/mol.
Where can I buy Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate?
You can request a quote for Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 3-{[(2-isopropyl-5-methylphenoxy)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.