二氯-2-苯并噻唑胺
TL;DR: 二氯-2-苯并噻唑胺 (CAS 16582-59-5) is a chemical compound with molecular formula C7H4Cl2N2S and molecular weight 217.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二氯-2-苯并噻唑胺
4,6-dichloro-1,3-benzothiazol-2-amine
Also Known As: 2-Amino-4,6-dichlorobenzothiazole, 4,6-dichloro-1,3-benzothiazol-2-amine, 2-Benzothiazolamine, 4,6-dichloro-, 2-Benzothiazolamine, dichloro-, Dichlorobenzothiazol-2-amine
| Molecular Formula | C7H4Cl2N2S |
|---|---|
| Molecular Weight | 217.95 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 67.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.94722 |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
| Solubility | 7.4 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 16582-59-5 |
|---|---|
| SMILES | C1=C(C=C(C2=C1SC(=N2)N)Cl)Cl |
| InChIKey | UZGRZSHGRZYCQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二氯-2-苯并噻唑胺 (CAS 16582-59-5), with molecular formula C7H4Cl2N2S and molecular weight 217.95 g/mol. IUPAC: 4,6-dichloro-1,3-benzothiazol-2-amine.
Chemical Property Profile of 二氯-2-苯并噻唑胺
Property Insights of 二氯-2-苯并噻唑胺
The XLogP value of 3.4 indicates that 二氯-2-苯并噻唑胺 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 二氯-2-苯并噻唑胺. Following Lipinski's Rule of Five, 二氯-2-苯并噻唑胺 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 二氯-2-苯并噻唑胺?
The CAS number of 二氯-2-苯并噻唑胺 is 16582-59-5.
What is the molecular formula of 二氯-2-苯并噻唑胺?
The molecular formula of 二氯-2-苯并噻唑胺 is C7H4Cl2N2S.
What is the molecular weight of 二氯-2-苯并噻唑胺?
The molecular weight of 二氯-2-苯并噻唑胺 is 217.95 g/mol.
Where can I buy 二氯-2-苯并噻唑胺?
You can request a quote for 二氯-2-苯并噻唑胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二氯-2-苯并噻唑胺?
Yes, KEHONG BIO provides custom synthesis services for 二氯-2-苯并噻唑胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.