2-Amino-4-methylbenzothiazole
TL;DR: 2-Amino-4-methylbenzothiazole (CAS 1477-42-5) is a chemical compound with molecular formula C8H8N2S and molecular weight 164.04082 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-1,3-benzothiazol-2-amine
Also Known As: 2-AMINO-4-METHYLBENZOTHIAZOLE, 4-methylbenzo[d]thiazol-2-amine, 2-Benzothiazolamine, 4-methyl-, 4-Methyl-1,3-benzothiazol-2-amine, 4-Methyl-2-benzothiazolamine
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H8N2S |
| Molecular Weight | 164.04082 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.04082 Da |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
| Melting Point | 279 to 282 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 75 °F (NTP, 1992) |
| SMILES | CC1=C2C(=CC=C1)SC(=N2)N |
| InChIKey | GRIATXVEXOFBGO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Amino-4-methylbenzothiazole
Property Insights of 2-Amino-4-methylbenzothiazole
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-4-methylbenzothiazole. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-4-methylbenzothiazole. Following Lipinski's Rule of Five, 2-Amino-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
What is the CAS number of 2-Amino-4-methylbenzothiazole?
The CAS number of 2-Amino-4-methylbenzothiazole is 1477-42-5.
What is the molecular formula of 2-Amino-4-methylbenzothiazole?
The molecular formula of 2-Amino-4-methylbenzothiazole is C8H8N2S.
What is the molecular weight of 2-Amino-4-methylbenzothiazole?
The molecular weight of 2-Amino-4-methylbenzothiazole is 164.04082 g/mol.
Where can I buy 2-Amino-4-methylbenzothiazole?
You can request a quote for 2-Amino-4-methylbenzothiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Amino-4-methylbenzothiazole?
Yes, CoreyChem provides custom synthesis services for 2-Amino-4-methylbenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.