N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine
TL;DR: N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine (CAS 862976-31-6) is a chemical compound with molecular formula C13H8ClFN2S and molecular weight 278.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine
Also Known As: N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine, N-(3-chlorophenyl)-6-fluorobenzo[d]thiazol-2-amine, AB00670929-01, F0646-4094, (m-chlorophenyl)(6-fluoro-1,3-benzothiazol-2-yl)amine
| Molecular Formula | C13H8ClFN2S |
|---|---|
| Molecular Weight | 278.01 g/mol |
| LogP | 4.8324 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0081 |
| Heavy Atoms | 18 |
| Complexity | 711.03265 |
Chemical Identifiers
| CAS Number | 862976-31-6 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NC2=NC3=C(S2)C=C(C=C3)F |
Product Overview
N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine (CAS 862976-31-6), with molecular formula C13H8ClFN2S and molecular weight 278.01 g/mol. IUPAC: N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine.
Chemical Property Profile of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine
Property Insights of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine
The XLogP value of 4.8324 indicates that N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine 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 N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine?
The CAS number of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine is 862976-31-6.
What is the molecular formula of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine?
The molecular formula of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine is C13H8ClFN2S.
What is the molecular weight of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine?
The molecular weight of N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine is 278.01 g/mol.
Where can I buy N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine?
You can request a quote for N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-6-fluoro-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.