6-Bromo-4-chloro-1,3-benzothiazol-2-amine
TL;DR: 6-Bromo-4-chloro-1,3-benzothiazol-2-amine (CAS 81822-77-7) is a chemical compound with molecular formula C7H4BrClN2S and molecular weight 261.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-4-chloro-1,3-benzothiazol-2-amine
Also Known As: 6-bromo-4-chloro-1,3-benzothiazol-2-amine, 6-bromo-4-chlorobenzo[d]thiazol-2-amine, 2-Benzothiazolamine, 6-bromo-4-chloro-, 6-bromo-4-chloro-benzothiazol-2-amine, 6-Bromo-4-chloro-benzothiazol-2-ylamine
| Molecular Formula | C7H4BrClN2S |
|---|---|
| Molecular Weight | 261.90 g/mol |
| LogP | 3.2944 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 261.8967 |
| Heavy Atoms | 12 |
| Complexity | 440.14417 |
Chemical Identifiers
| CAS Number | 81822-77-7 |
|---|---|
| SMILES | C1=C(C=C(C2=C1SC(=N2)N)Cl)Br |
Product Overview
6-Bromo-4-chloro-1,3-benzothiazol-2-amine (CAS 81822-77-7), with molecular formula C7H4BrClN2S and molecular weight 261.90 g/mol. IUPAC: 6-bromo-4-chloro-1,3-benzothiazol-2-amine.
Chemical Property Profile of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine
Property Insights of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine
The XLogP value of 3.2944 indicates that 6-Bromo-4-chloro-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 38.91 Ų, 6-Bromo-4-chloro-1,3-benzothiazol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-4-chloro-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 6-Bromo-4-chloro-1,3-benzothiazol-2-amine?
The CAS number of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine is 81822-77-7.
What is the molecular formula of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine?
The molecular formula of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine is C7H4BrClN2S.
What is the molecular weight of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine?
The molecular weight of 6-Bromo-4-chloro-1,3-benzothiazol-2-amine is 261.90 g/mol.
Where can I buy 6-Bromo-4-chloro-1,3-benzothiazol-2-amine?
You can request a quote for 6-Bromo-4-chloro-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 6-Bromo-4-chloro-1,3-benzothiazol-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-4-chloro-1,3-benzothiazol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.