4,6-Dichloro-N-methyl-2-benzothiazolamine
TL;DR: 4,6-Dichloro-N-methyl-2-benzothiazolamine (CAS 685124-14-5) is a chemical compound with molecular formula C8H6Cl2N2S and molecular weight 231.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-N-methyl-1,3-benzothiazol-2-amine
Also Known As: Maybridge4_003175, 4,6-dichloro-N-methyl-1,3-benzothiazol-2-amine, 4,6-Dichloro-N-methyl-2-benzothiazolamine, BRD-K69606171-001-01-8, RefChem:285827
| Molecular Formula | C8H6Cl2N2S |
|---|---|
| Molecular Weight | 231.96 g/mol |
| LogP | 3.6448 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.96288 |
| Heavy Atoms | 13 |
| Complexity | 452.5859 |
Chemical Identifiers
| CAS Number | 685124-14-5 |
|---|---|
| SMILES | CNC1=NC2=C(S1)C=C(C=C2Cl)Cl |
Product Overview
4,6-Dichloro-N-methyl-2-benzothiazolamine (CAS 685124-14-5), with molecular formula C8H6Cl2N2S and molecular weight 231.96 g/mol. IUPAC: 4,6-dichloro-N-methyl-1,3-benzothiazol-2-amine.
Chemical Property Profile of 4,6-Dichloro-N-methyl-2-benzothiazolamine
Property Insights of 4,6-Dichloro-N-methyl-2-benzothiazolamine
The XLogP value of 3.6448 indicates that 4,6-Dichloro-N-methyl-2-benzothiazolamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.92 Ų, 4,6-Dichloro-N-methyl-2-benzothiazolamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Dichloro-N-methyl-2-benzothiazolamine 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 4,6-Dichloro-N-methyl-2-benzothiazolamine?
The CAS number of 4,6-Dichloro-N-methyl-2-benzothiazolamine is 685124-14-5.
What is the molecular formula of 4,6-Dichloro-N-methyl-2-benzothiazolamine?
The molecular formula of 4,6-Dichloro-N-methyl-2-benzothiazolamine is C8H6Cl2N2S.
What is the molecular weight of 4,6-Dichloro-N-methyl-2-benzothiazolamine?
The molecular weight of 4,6-Dichloro-N-methyl-2-benzothiazolamine is 231.96 g/mol.
Where can I buy 4,6-Dichloro-N-methyl-2-benzothiazolamine?
You can request a quote for 4,6-Dichloro-N-methyl-2-benzothiazolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dichloro-N-methyl-2-benzothiazolamine?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dichloro-N-methyl-2-benzothiazolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.