AN-329/41104220
TL;DR: AN-329/41104220 (CAS 445409-21-2) is a chemical compound with molecular formula C22H27BrN2O4S and molecular weight 494.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
Also Known As: AN-329/41104220, 2-(4-bromo-2-isopropyl-5-methylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide, 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide, 2-[4-bromo-5-methyl-2-(propan-2-yl)phenoxy]-N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]acetamide
| Molecular Formula | C22H27BrN2O4S |
|---|---|
| Molecular Weight | 494.09 g/mol |
| LogP | 4.68292 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.0875 |
| Heavy Atoms | 30 |
| Complexity | 1014.1782 |
Chemical Identifiers
| CAS Number | 445409-21-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3 |
Product Overview
AN-329/41104220 (CAS 445409-21-2), with molecular formula C22H27BrN2O4S and molecular weight 494.09 g/mol. IUPAC: 2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide.
Chemical Property Profile of AN-329/41104220
Property Insights of AN-329/41104220
The XLogP value of 4.68292 indicates that AN-329/41104220 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/41104220. Following Lipinski's Rule of Five, AN-329/41104220 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 AN-329/41104220?
The CAS number of AN-329/41104220 is 445409-21-2.
What is the molecular formula of AN-329/41104220?
The molecular formula of AN-329/41104220 is C22H27BrN2O4S.
What is the molecular weight of AN-329/41104220?
The molecular weight of AN-329/41104220 is 494.09 g/mol.
Where can I buy AN-329/41104220?
You can request a quote for AN-329/41104220 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/41104220?
Yes, KEHONG BIO provides custom synthesis services for AN-329/41104220 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.