AB00979467-01
TL;DR: AB00979467-01 (CAS 716350-91-3) is a chemical compound with molecular formula C19H11ClF3NO7S2 and molecular weight 520.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-chlorophenyl)sulfonylphenoxy]-2-nitro-4-(trifluoromethylsulfonyl)benzene
Also Known As: AB00979467-01, 1-[(4-Chlorophenyl)sulfonyl]-4-[2-nitro-4-[(trifluoromethyl)sulfonyl]phenoxy]benzene, 1-[4-(4-Chlorobenzene-1-sulfonyl)phenoxy]-2-nitro-4-(trifluoromethanesulfonyl)benzene, 1-[4-(4-chlorophenyl)sulfonylphenoxy]-2-nitro-4-(trifluoromethylsulfonyl)benzene
| Molecular Formula | C19H11ClF3NO7S2 |
|---|---|
| Molecular Weight | 520.96 g/mol |
| LogP | 5.1668 |
| Topological Polar Surface Area | 120.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 520.96173 |
| Heavy Atoms | 33 |
| Complexity | 1421.7032 |
Chemical Identifiers
| CAS Number | 716350-91-3 |
|---|---|
| SMILES | C1=CC(=CC=C1OC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)Cl |
Product Overview
AB00979467-01 (CAS 716350-91-3), with molecular formula C19H11ClF3NO7S2 and molecular weight 520.96 g/mol. IUPAC: 1-[4-(4-chlorophenyl)sulfonylphenoxy]-2-nitro-4-(trifluoromethylsulfonyl)benzene.
Chemical Property Profile of AB00979467-01
Property Insights of AB00979467-01
The XLogP value of 5.1668 indicates that AB00979467-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.65 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00979467-01. Following Lipinski's Rule of Five, AB00979467-01 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00979467-01?
The CAS number of AB00979467-01 is 716350-91-3.
What is the molecular formula of AB00979467-01?
The molecular formula of AB00979467-01 is C19H11ClF3NO7S2.
What is the molecular weight of AB00979467-01?
The molecular weight of AB00979467-01 is 520.96 g/mol.
Where can I buy AB00979467-01?
You can request a quote for AB00979467-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00979467-01?
Yes, KEHONG BIO provides custom synthesis services for AB00979467-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.