2-Phenyl-benzothiazol-6-ylamine
TL;DR: 2-Phenyl-benzothiazol-6-ylamine (CAS 6392-97-8) is a chemical compound with molecular formula C13H10N2S and molecular weight 226.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-1,3-benzothiazol-6-amine
Also Known As: 2-Phenyl-benzothiazol-6-ylamine, 2-Phenylbenzo[d]thiazol-6-amine, 2-phenyl-1,3-benzothiazol-6-amine, 2-phenyl-6-aminobenzothiazole, 6-Amino-2-phenylbenzothiazole
| Molecular Formula | C13H10N2S |
|---|---|
| Molecular Weight | 226.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.05647 |
| Heavy Atoms | 16 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 6392-97-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC3=C(S2)C=C(C=C3)N |
| InChIKey | KRLJYUSJAVJLTM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Phenyl-benzothiazol-6-ylamine (CAS 6392-97-8), with molecular formula C13H10N2S and molecular weight 226.06 g/mol. IUPAC: 2-phenyl-1,3-benzothiazol-6-amine.
Chemical Property Profile of 2-Phenyl-benzothiazol-6-ylamine
Property Insights of 2-Phenyl-benzothiazol-6-ylamine
The XLogP value of 3.6 indicates that 2-Phenyl-benzothiazol-6-ylamine 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-Phenyl-benzothiazol-6-ylamine. Following Lipinski's Rule of Five, 2-Phenyl-benzothiazol-6-ylamine 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-Phenyl-benzothiazol-6-ylamine?
The CAS number of 2-Phenyl-benzothiazol-6-ylamine is 6392-97-8.
What is the molecular formula of 2-Phenyl-benzothiazol-6-ylamine?
The molecular formula of 2-Phenyl-benzothiazol-6-ylamine is C13H10N2S.
What is the molecular weight of 2-Phenyl-benzothiazol-6-ylamine?
The molecular weight of 2-Phenyl-benzothiazol-6-ylamine is 226.06 g/mol.
Where can I buy 2-Phenyl-benzothiazol-6-ylamine?
You can request a quote for 2-Phenyl-benzothiazol-6-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-benzothiazol-6-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-benzothiazol-6-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.