(6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone
TL;DR: (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone (CAS 732301-72-3) is a chemical compound with molecular formula C14H6Cl3NO3S2 and molecular weight 404.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-chloro-1,1-dioxo-1λ6,4,2-benzodithiazin-3-yl)-(3,4-dichlorophenyl)methanone
Also Known As: (6-chloro-1,1-dioxo-1, (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone, 3-(6-chloro-1,4,2-benzodithiazinyl) 3,4-dichlorophenyl ketone, 3-(6-Chloro-1,1-dioxo-1,4,2-benzodithiazinyl) 3,4-dichlorophenyl ketone, (6-chloro-1,1-dioxido-1,4,2-benzodithiazin-3-yl)(3,4-dichlorophenyl)methanone
| Molecular Formula | C14H6Cl3NO3S2 |
|---|---|
| Molecular Weight | 404.89 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 97.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.88547 |
| Heavy Atoms | 23 |
| Complexity | 619.0 |
Chemical Identifiers
| CAS Number | 732301-72-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)C2=NS(=O)(=O)C3=C(S2)C=C(C=C3)Cl)Cl)Cl |
| InChIKey | BLWVFDOGVHTGIX-UHFFFAOYSA-N |
Product Overview
(6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone (CAS 732301-72-3), with molecular formula C14H6Cl3NO3S2 and molecular weight 404.89 g/mol. IUPAC: (6-chloro-1,1-dioxo-1λ6,4,2-benzodithiazin-3-yl)-(3,4-dichlorophenyl)methanone.
Chemical Property Profile of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone
Property Insights of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone
The XLogP value of 4.9 indicates that (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone. Following Lipinski's Rule of Five, (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone has 0 hydrogen bond donor(s) and 5 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 (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone?
The CAS number of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone is 732301-72-3.
What is the molecular formula of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone?
The molecular formula of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone is C14H6Cl3NO3S2.
What is the molecular weight of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone?
The molecular weight of (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone is 404.89 g/mol.
Where can I buy (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone?
You can request a quote for (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (6-Chloro-1,1-dioxidobenzo[e][1,4,2]dithiazin-3-yl)(3,4-dichlorophenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.