AN-698/41760777
TL;DR: AN-698/41760777 (CAS 692772-28-4) is a chemical compound with molecular formula C24H27Cl2N5O3S and molecular weight 535.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(4-propan-2-ylphenoxy)acetamide
Also Known As: AN-698/41760777, N-(3,4-dichlorophenyl)-2-({4-ethyl-5-[({[4-(propan-2-yl)phenoxy]acetyl}amino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide, N-[[5-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(4-propan-2-ylphenoxy)acetamide, N-(3,4-dichlorophenyl)-2-{[4-ethyl-5-({[(4-isopropylphenoxy)acetyl]amino}methyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
| Molecular Formula | C24H27Cl2N5O3S |
|---|---|
| Molecular Weight | 535.12 g/mol |
| LogP | 5.1542 |
| Topological Polar Surface Area | 98.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 535.12115 |
| Heavy Atoms | 35 |
| Complexity | 1168.4663 |
Chemical Identifiers
| CAS Number | 692772-28-4 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)Cl)CNC(=O)COC3=CC=C(C=C3)C(C)C |
Product Overview
AN-698/41760777 (CAS 692772-28-4), with molecular formula C24H27Cl2N5O3S and molecular weight 535.12 g/mol. IUPAC: N-[[5-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]methyl]-2-(4-propan-2-ylphenoxy)acetamide.
Chemical Property Profile of AN-698/41760777
Property Insights of AN-698/41760777
The XLogP value of 5.1542 indicates that AN-698/41760777 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.14 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-698/41760777. Following Lipinski's Rule of Five, AN-698/41760777 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 AN-698/41760777?
The CAS number of AN-698/41760777 is 692772-28-4.
What is the molecular formula of AN-698/41760777?
The molecular formula of AN-698/41760777 is C24H27Cl2N5O3S.
What is the molecular weight of AN-698/41760777?
The molecular weight of AN-698/41760777 is 535.12 g/mol.
Where can I buy AN-698/41760777?
You can request a quote for AN-698/41760777 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-698/41760777?
Yes, KEHONG BIO provides custom synthesis services for AN-698/41760777 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.