![2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide structure](/static/products/883/883909-07-7.png)
2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide
TL;DR: 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide (CAS 883909-07-7) is a chemical compound with molecular formula C17H13ClN2O4S and molecular weight 376.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-1,1-dioxo-1,2-benzothiazol-3-one
Also Known As: 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide, 2-[[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-1,1-dioxo-1,2-benzothiazol-3-one, 2-[3-(4-Chloro-phenyl)-4,5-dihydro-isoxazol-5-ylmethyl]-1,1-dioxo-1,2-dihydro-1lambda*6*-benzo[d]isot hiazol-3-one, 2-{[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-1,2-benzothiazol-3(2H)-one 1,1-dioxide
| Molecular Formula | C17H13ClN2O4S |
|---|---|
| Molecular Weight | 376.03 g/mol |
| LogP | 2.6777 |
| Topological Polar Surface Area | 76.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 376.02844 |
| Heavy Atoms | 25 |
| Complexity | 985.96234 |
Chemical Identifiers
| CAS Number | 883909-07-7 |
|---|---|
| SMILES | C1C(ON=C1C2=CC=C(C=C2)Cl)CN3C(=O)C4=CC=CC=C4S3(=O)=O |
Product Overview
2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide (CAS 883909-07-7), with molecular formula C17H13ClN2O4S and molecular weight 376.03 g/mol. IUPAC: 2-[[3-(4-chlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-1,1-dioxo-1,2-benzothiazol-3-one.
Chemical Property Profile of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide
Property Insights of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide
The XLogP value of 2.6777 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide. The TPSA of 76.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide. Following Lipinski's Rule of Five, 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide 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 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide?
The CAS number of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide is 883909-07-7.
What is the molecular formula of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide?
The molecular formula of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide is C17H13ClN2O4S.
What is the molecular weight of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide?
The molecular weight of 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide is 376.03 g/mol.
Where can I buy 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide?
You can request a quote for 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-(4-chlorophenyl)-4,5-dihydroisoxazol-5-yl)methyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.