1,2-Benzisothiazol-3(2H)-one, 2-amino-
TL;DR: 1,2-Benzisothiazol-3(2H)-one, 2-amino- (CAS 200421-25-6) is a chemical compound with molecular formula C7H6N2OS and molecular weight 166.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1,2-benzothiazol-3-one
Also Known As: 2-aminobenzo[d]isothiazol-3(2H)-one, 1,2-Benzisothiazol-3(2H)-one, 2-amino-, 2-aminobenzo[d]isothiazol-3-one, 2-amino-1,2-benzothiazol-3-one, 2-Amino-1,2-benzothiazol-3(2H)-one
| Molecular Formula | C7H6N2OS |
|---|---|
| Molecular Weight | 166.02 g/mol |
| LogP | 0.7768 |
| Topological Polar Surface Area | 48.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.02008 |
| Heavy Atoms | 11 |
| Complexity | 442.88245 |
Chemical Identifiers
| CAS Number | 200421-25-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(S2)N |
Product Overview
1,2-Benzisothiazol-3(2H)-one, 2-amino- (CAS 200421-25-6), with molecular formula C7H6N2OS and molecular weight 166.02 g/mol. IUPAC: 2-amino-1,2-benzothiazol-3-one.
Chemical Property Profile of 1,2-Benzisothiazol-3(2H)-one, 2-amino-
Property Insights of 1,2-Benzisothiazol-3(2H)-one, 2-amino-
The XLogP value of 0.7768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Benzisothiazol-3(2H)-one, 2-amino-. With a topological polar surface area (TPSA) of 48.02 Ų, 1,2-Benzisothiazol-3(2H)-one, 2-amino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Benzisothiazol-3(2H)-one, 2-amino- has 1 hydrogen bond donor(s) and 3 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 1,2-Benzisothiazol-3(2H)-one, 2-amino-?
The CAS number of 1,2-Benzisothiazol-3(2H)-one, 2-amino- is 200421-25-6.
What is the molecular formula of 1,2-Benzisothiazol-3(2H)-one, 2-amino-?
The molecular formula of 1,2-Benzisothiazol-3(2H)-one, 2-amino- is C7H6N2OS.
What is the molecular weight of 1,2-Benzisothiazol-3(2H)-one, 2-amino-?
The molecular weight of 1,2-Benzisothiazol-3(2H)-one, 2-amino- is 166.02 g/mol.
Where can I buy 1,2-Benzisothiazol-3(2H)-one, 2-amino-?
You can request a quote for 1,2-Benzisothiazol-3(2H)-one, 2-amino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Benzisothiazol-3(2H)-one, 2-amino-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Benzisothiazol-3(2H)-one, 2-amino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.