2-(2-Aminophenyl)-4-methylbenzothiazole
TL;DR: 2-(2-Aminophenyl)-4-methylbenzothiazole (CAS 20600-49-1) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-1,3-benzothiazol-2-yl)aniline
Also Known As: 2-(2-Aminophenyl)-4-methylbenzothiazole, Benzothiazole, 2-(o-aminophenyl)-4-methyl-, 2-(4-methyl-1,3-benzothiazol-2-yl)aniline, 2-(4-Methylbenzothiazol-2-yl)aniline, 2-(4-methylbenzo[d]thiazol-2-yl)aniline
| Molecular Formula | C14H12N2S |
|---|---|
| Molecular Weight | 240.07 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.07211 |
| Heavy Atoms | 17 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 20600-49-1 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)SC(=N2)C3=CC=CC=C3N |
| InChIKey | ROGQKYRGDXKCQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Aminophenyl)-4-methylbenzothiazole (CAS 20600-49-1), with molecular formula C14H12N2S and molecular weight 240.07 g/mol. IUPAC: 2-(4-methyl-1,3-benzothiazol-2-yl)aniline.
Chemical Property Profile of 2-(2-Aminophenyl)-4-methylbenzothiazole
Property Insights of 2-(2-Aminophenyl)-4-methylbenzothiazole
The XLogP value of 3.7 indicates that 2-(2-Aminophenyl)-4-methylbenzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Aminophenyl)-4-methylbenzothiazole. Following Lipinski's Rule of Five, 2-(2-Aminophenyl)-4-methylbenzothiazole 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 2-(2-Aminophenyl)-4-methylbenzothiazole?
The CAS number of 2-(2-Aminophenyl)-4-methylbenzothiazole is 20600-49-1.
What is the molecular formula of 2-(2-Aminophenyl)-4-methylbenzothiazole?
The molecular formula of 2-(2-Aminophenyl)-4-methylbenzothiazole is C14H12N2S.
What is the molecular weight of 2-(2-Aminophenyl)-4-methylbenzothiazole?
The molecular weight of 2-(2-Aminophenyl)-4-methylbenzothiazole is 240.07 g/mol.
Where can I buy 2-(2-Aminophenyl)-4-methylbenzothiazole?
You can request a quote for 2-(2-Aminophenyl)-4-methylbenzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Aminophenyl)-4-methylbenzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Aminophenyl)-4-methylbenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.