Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-
TL;DR: Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- (CAS 92-01-3) is a chemical compound with molecular formula C14H12N2O3S2 and molecular weight 320.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid
Also Known As: Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-, 2-Amino-5-(6-methylbenzothiazol-2-yl)benzenesulphonic acid, 2-Amino-5-(6-methyl-2-benzothiazolyl)benzenesulfonic acid, 2-amino-5-(6-methylbenzothiazol-2-yl)benzensulfonsyre, 2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid
| Molecular Formula | C14H12N2O3S2 |
|---|---|
| Molecular Weight | 320.03 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.02893 |
| Heavy Atoms | 21 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 92-01-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(S2)C3=CC(=C(C=C3)N)S(=O)(=O)O |
| InChIKey | SGFXNJIQRFEOIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- (CAS 92-01-3), with molecular formula C14H12N2O3S2 and molecular weight 320.03 g/mol. IUPAC: 2-amino-5-(6-methyl-1,3-benzothiazol-2-yl)benzenesulfonic acid.
Chemical Property Profile of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-
Property Insights of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-
The XLogP value of 3.0 indicates that Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-. Following Lipinski's Rule of Five, Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- has 2 hydrogen bond donor(s) and 6 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 Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-?
The CAS number of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- is 92-01-3.
What is the molecular formula of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-?
The molecular formula of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- is C14H12N2O3S2.
What is the molecular weight of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-?
The molecular weight of Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- is 320.03 g/mol.
Where can I buy Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-?
You can request a quote for Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzenesulfonic acid, 2-amino-5-(6-methyl-2-benzothiazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.