Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide
TL;DR: Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide (CAS 21387-30-4) is a chemical compound with molecular formula C20H14N2O3S and molecular weight 362.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenylbenzamide
Also Known As: 3-1,2-benzisothiazole1,1-dioxide, 3- -1,2-benzisothiazole1,1-dioxide, 3-(Benzoylphenylamino)benzisothiazole-S,S-dioxide, Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide, N-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenylbenzamide
| Molecular Formula | C20H14N2O3S |
|---|---|
| Molecular Weight | 362.07 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.0725 |
| Heavy Atoms | 26 |
| Complexity | 655.0 |
Chemical Identifiers
| CAS Number | 21387-30-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N(C2=CC=CC=C2)C3=NS(=O)(=O)C4=CC=CC=C43 |
| InChIKey | BBKYFWAKEOTVOO-UHFFFAOYSA-N |
Product Overview
Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide (CAS 21387-30-4), with molecular formula C20H14N2O3S and molecular weight 362.07 g/mol. IUPAC: N-(1,1-dioxo-1,2-benzothiazol-3-yl)-N-phenylbenzamide.
Chemical Property Profile of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide
Property Insights of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide
The XLogP value of 3.7 indicates that Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide. Following Lipinski's Rule of Five, Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide has 0 hydrogen bond donor(s) and 4 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 Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide?
The CAS number of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide is 21387-30-4.
What is the molecular formula of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide?
The molecular formula of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide is C20H14N2O3S.
What is the molecular weight of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide?
The molecular weight of Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide is 362.07 g/mol.
Where can I buy Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide?
You can request a quote for Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Benzanilide, N-1,2-benzisothiazol-3-yl-, S,S-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.