AN-329/40922877
TL;DR: AN-329/40922877 (CAS 444151-61-5) is a chemical compound with molecular formula C21H16ClN3O5S3 and molecular weight 520.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-[4-[(4-sulfamoylphenyl)sulfamoyl]phenyl]-1-benzothiophene-2-carboxamide
Also Known As: AN-329/40922877, 3-chloro-N-[4-[(4-sulfamoylphenyl)sulfamoyl]phenyl]-1-benzothiophene-2-carboxamide, 3-chloro-N-{4-[(4-sulfamoylphenyl)sulfamoyl]phenyl}-1-benzothiophene-2-carboxamide, N-[4-({[4-(aminosulfonyl)phenyl]amino}sulfonyl)phenyl]-3-chloro-1-benzothiophene-2-carboxamide, N-(4-{[4-(aminosulfonyl)anilino]sulfonyl}phenyl)-3-chloro-1-benzothiophene-2-carboxamide
| Molecular Formula | C21H16ClN3O5S3 |
|---|---|
| Molecular Weight | 520.99 g/mol |
| LogP | 4.2552 |
| Topological Polar Surface Area | 135.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.9941 |
| Heavy Atoms | 33 |
| Complexity | 1563.9497 |
Chemical Identifiers
| CAS Number | 444151-61-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(S2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=CC=C(C=C4)S(=O)(=O)N)Cl |
Product Overview
AN-329/40922877 (CAS 444151-61-5), with molecular formula C21H16ClN3O5S3 and molecular weight 520.99 g/mol. IUPAC: 3-chloro-N-[4-[(4-sulfamoylphenyl)sulfamoyl]phenyl]-1-benzothiophene-2-carboxamide.
Chemical Property Profile of AN-329/40922877
Property Insights of AN-329/40922877
The XLogP value of 4.2552 indicates that AN-329/40922877 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-329/40922877. Following Lipinski's Rule of Five, AN-329/40922877 has 3 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-329/40922877?
The CAS number of AN-329/40922877 is 444151-61-5.
What is the molecular formula of AN-329/40922877?
The molecular formula of AN-329/40922877 is C21H16ClN3O5S3.
What is the molecular weight of AN-329/40922877?
The molecular weight of AN-329/40922877 is 520.99 g/mol.
Where can I buy AN-329/40922877?
You can request a quote for AN-329/40922877 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-329/40922877?
Yes, KEHONG BIO provides custom synthesis services for AN-329/40922877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.