2(3H)-Benzothiazolone, 6-amino-
TL;DR: 2(3H)-Benzothiazolone, 6-amino- (CAS 10071-13-3) 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.
6-amino-3H-1,3-benzothiazol-2-one
Also Known As: 6-Aminobenzo[d]thiazol-2(3H)-one, 6-amino-2(3H)-benzothiazolone, 6-Amino-1,3-benzothiazol-2(3H)-one, 6-Amino-3H-benzothiazol-2-one, 6-Aminobenzothiazolone
| Molecular Formula | C7H6N2OS |
|---|---|
| Molecular Weight | 166.02 g/mol |
| LogP | 1.1718 |
| Topological Polar Surface Area | 58.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.02008 |
| Heavy Atoms | 11 |
| Complexity | 442.88245 |
Chemical Identifiers
| CAS Number | 10071-13-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1N)SC(=O)N2 |
Product Overview
2(3H)-Benzothiazolone, 6-amino- (CAS 10071-13-3), with molecular formula C7H6N2OS and molecular weight 166.02 g/mol. IUPAC: 6-amino-3H-1,3-benzothiazol-2-one.
Chemical Property Profile of 2(3H)-Benzothiazolone, 6-amino-
Property Insights of 2(3H)-Benzothiazolone, 6-amino-
The XLogP value of 1.1718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(3H)-Benzothiazolone, 6-amino-. With a topological polar surface area (TPSA) of 58.88 Ų, 2(3H)-Benzothiazolone, 6-amino- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(3H)-Benzothiazolone, 6-amino- has 2 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 2(3H)-Benzothiazolone, 6-amino-?
The CAS number of 2(3H)-Benzothiazolone, 6-amino- is 10071-13-3.
What is the molecular formula of 2(3H)-Benzothiazolone, 6-amino-?
The molecular formula of 2(3H)-Benzothiazolone, 6-amino- is C7H6N2OS.
What is the molecular weight of 2(3H)-Benzothiazolone, 6-amino-?
The molecular weight of 2(3H)-Benzothiazolone, 6-amino- is 166.02 g/mol.
Where can I buy 2(3H)-Benzothiazolone, 6-amino-?
You can request a quote for 2(3H)-Benzothiazolone, 6-amino- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Benzothiazolone, 6-amino-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Benzothiazolone, 6-amino- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.