2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine
TL;DR: 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine (CAS 210428-37-8) is a chemical compound with molecular formula C9H9ClN2S and molecular weight 212.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-chloro-1,3-benzothiazol-2-yl)ethanamine
Also Known As: 2-(5-chloro-1,3-benzothiazol-2-yl)ethanamine, 2-(5-CHLOROBENZO[D]THIAZOL-2-YL)ETHANAMINE, 2-Benzothiazoleethanamine,5-chloro-, 5-CHLORO-2-BENZOTHIAZOLEETHAMINE, 2-(5-chlorobenzothiazol-2-yl)ethanamine
| Molecular Formula | C9H9ClN2S |
|---|---|
| Molecular Weight | 212.02 g/mol |
| LogP | 2.4509 |
| Topological Polar Surface Area | 38.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.0175 |
| Heavy Atoms | 13 |
| Complexity | 424.47195 |
Chemical Identifiers
| CAS Number | 210428-37-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)N=C(S2)CCN |
Product Overview
2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine (CAS 210428-37-8), with molecular formula C9H9ClN2S and molecular weight 212.02 g/mol. IUPAC: 2-(5-chloro-1,3-benzothiazol-2-yl)ethanamine.
Chemical Property Profile of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine
Property Insights of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine
The XLogP value of 2.4509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine. With a topological polar surface area (TPSA) of 38.91 Ų, 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine 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-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine?
The CAS number of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine is 210428-37-8.
What is the molecular formula of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine?
The molecular formula of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine is C9H9ClN2S.
What is the molecular weight of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine?
The molecular weight of 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine is 212.02 g/mol.
Where can I buy 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine?
You can request a quote for 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Chloro-1,3-benzothiazol-2-yl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.