AN-989/40683601
TL;DR: AN-989/40683601 (CAS 428849-22-3) is a chemical compound with molecular formula C19H13Cl2NO6S and molecular weight 452.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-chloro-4-[(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-6-methoxyphenoxy]acetic acid
Also Known As: AN-989/40683601, AB00110131-01, (2-chloro-4-{(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)acetic acid, (2-chloro-4-{[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)acetic acid, 2-[2-chloro-4-[(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-6-methoxyphenoxy]acetic acid
| Molecular Formula | C19H13Cl2NO6S |
|---|---|
| Molecular Weight | 452.98 g/mol |
| LogP | 4.7063 |
| Topological Polar Surface Area | 93.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.98407 |
| Heavy Atoms | 29 |
| Complexity | 1022.1046 |
Chemical Identifiers
| CAS Number | 428849-22-3 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)/C=C\2/C(=O)N(C(=O)S2)C3=CC=C(C=C3)Cl)Cl)OCC(=O)O |
Product Overview
AN-989/40683601 (CAS 428849-22-3), with molecular formula C19H13Cl2NO6S and molecular weight 452.98 g/mol. IUPAC: 2-[2-chloro-4-[(Z)-[3-(4-chlorophenyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-6-methoxyphenoxy]acetic acid.
Chemical Property Profile of AN-989/40683601
Property Insights of AN-989/40683601
The XLogP value of 4.7063 indicates that AN-989/40683601 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-989/40683601. Following Lipinski's Rule of Five, AN-989/40683601 has 1 hydrogen bond donor(s) and 6 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-989/40683601?
The CAS number of AN-989/40683601 is 428849-22-3.
What is the molecular formula of AN-989/40683601?
The molecular formula of AN-989/40683601 is C19H13Cl2NO6S.
What is the molecular weight of AN-989/40683601?
The molecular weight of AN-989/40683601 is 452.98 g/mol.
Where can I buy AN-989/40683601?
You can request a quote for AN-989/40683601 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-989/40683601?
Yes, KEHONG BIO provides custom synthesis services for AN-989/40683601 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.