AN-698/42147370
TL;DR: AN-698/42147370 (CAS 665018-85-9) is a chemical compound with molecular formula C19H15Cl2N5O3S and molecular weight 463.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dichlorophenyl)acetamide
Also Known As: AN-698/42147370, 2-{[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dichlorophenyl)acetamide, 2-[[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dichlorophenyl)acetamide
| Molecular Formula | C19H15Cl2N5O3S |
|---|---|
| Molecular Weight | 463.03 g/mol |
| LogP | 4.4513 |
| Topological Polar Surface Area | 108.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 463.02725 |
| Heavy Atoms | 30 |
| Complexity | 1240.3661 |
Chemical Identifiers
| CAS Number | 665018-85-9 |
|---|---|
| SMILES | COC1=CC=CC2=C1OC(=C2)C3=NN=C(N3N)SCC(=O)NC4=C(C=CC(=C4)Cl)Cl |
Product Overview
AN-698/42147370 (CAS 665018-85-9), with molecular formula C19H15Cl2N5O3S and molecular weight 463.03 g/mol. IUPAC: 2-[[4-amino-5-(7-methoxy-1-benzofuran-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dichlorophenyl)acetamide.
Chemical Property Profile of AN-698/42147370
Property Insights of AN-698/42147370
The XLogP value of 4.4513 indicates that AN-698/42147370 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.2 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-698/42147370. Following Lipinski's Rule of Five, AN-698/42147370 has 2 hydrogen bond donor(s) and 7 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-698/42147370?
The CAS number of AN-698/42147370 is 665018-85-9.
What is the molecular formula of AN-698/42147370?
The molecular formula of AN-698/42147370 is C19H15Cl2N5O3S.
What is the molecular weight of AN-698/42147370?
The molecular weight of AN-698/42147370 is 463.03 g/mol.
Where can I buy AN-698/42147370?
You can request a quote for AN-698/42147370 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-698/42147370?
Yes, KEHONG BIO provides custom synthesis services for AN-698/42147370 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.