2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid
TL;DR: 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid (CAS 89284-29-7) is a chemical compound with molecular formula C16H14N4O2S and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoic acid
Also Known As: BTAMB, 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid, 2-(1,3-benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoic acid, 2-(2-Benzothiazolylazo)-5-(dimethylamino)benzoic acid, 2-[(Benzothiazol-2-yl)azo]-5-dimethylaminobenzoic acid
| Molecular Formula | C16H14N4O2S |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.08374 |
| Heavy Atoms | 23 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 89284-29-7 |
|---|---|
| SMILES | CN(C)C1=CC(=C(C=C1)N=NC2=NC3=CC=CC=C3S2)C(=O)O |
| InChIKey | MFIPFYVHTJNYGB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid (CAS 89284-29-7), with molecular formula C16H14N4O2S and molecular weight 326.08 g/mol. IUPAC: 2-(1,3-benzothiazol-2-yldiazenyl)-5-(dimethylamino)benzoic acid.
Chemical Property Profile of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid
Property Insights of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid
The XLogP value of 4.1 indicates that 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid. Following Lipinski's Rule of Five, 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid has 1 hydrogen bond donor(s) and 7 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-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid?
The CAS number of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid is 89284-29-7.
What is the molecular formula of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid?
The molecular formula of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid is C16H14N4O2S.
What is the molecular weight of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid?
The molecular weight of 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid is 326.08 g/mol.
Where can I buy 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid?
You can request a quote for 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Benzothiazolylazo)-5-dimethylaminobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.