2-氨基苯并噻唑
TL;DR: 2-氨基苯并噻唑 (CAS 136-95-8) is a chemical compound with molecular formula C7H6N2S and molecular weight 150.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基苯并噻唑
1,3-benzothiazol-2-amine
Also Known As: 2-AMINOBENZOTHIAZOLE, benzo[d]thiazol-2-amine, 2-Benzothiazolamine, 1,3-Benzothiazol-2-amine, Benzothiazol-2-ylamine
| Molecular Formula | C7H6N2S |
|---|---|
| Molecular Weight | 150.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 150.02516 |
| Heavy Atoms | 10 |
| Complexity | 129.0 |
| Melting Point | 132.2 °C |
| Boiling Point | Decomposes |
| Density | 0.5 - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 66 °F (NTP, 1992) |
| Vapor Pressure | 0.000112 [mmHg] |
Chemical Identifiers
| CAS Number | 136-95-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)N |
| InChIKey | UHGULLIUJBCTEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氨基苯并噻唑 (CAS 136-95-8), with molecular formula C7H6N2S and molecular weight 150.03 g/mol. IUPAC: 1,3-benzothiazol-2-amine.
Chemical Property Profile of 2-氨基苯并噻唑
Property Insights of 2-氨基苯并噻唑
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氨基苯并噻唑. The TPSA of 67.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-氨基苯并噻唑. Following Lipinski's Rule of Five, 2-氨基苯并噻唑 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-氨基苯并噻唑?
The CAS number of 2-氨基苯并噻唑 is 136-95-8.
What is the molecular formula of 2-氨基苯并噻唑?
The molecular formula of 2-氨基苯并噻唑 is C7H6N2S.
What is the molecular weight of 2-氨基苯并噻唑?
The molecular weight of 2-氨基苯并噻唑 is 150.03 g/mol.
Where can I buy 2-氨基苯并噻唑?
You can request a quote for 2-氨基苯并噻唑 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基苯并噻唑?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基苯并噻唑 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.