Isothiazole, tribromo-
TL;DR: Isothiazole, tribromo- (CAS 71091-87-7) is a chemical compound with molecular formula C3Br3NS and molecular weight 318.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-tribromo-1,2-thiazole
Also Known As: Tribromoisothiazole, Isothiazole, tribromo-, 3,4,5-tribromo-1,2-thiazole, RefChem:350128
| Molecular Formula | C3Br3NS |
|---|---|
| Molecular Weight | 318.73 g/mol |
| LogP | 3.4306 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 318.73016 |
| Heavy Atoms | 8 |
| Complexity | 176.90865 |
Chemical Identifiers
| CAS Number | 71091-87-7 |
|---|---|
| SMILES | C1(=C(SN=C1Br)Br)Br |
Product Overview
Isothiazole, tribromo- (CAS 71091-87-7), with molecular formula C3Br3NS and molecular weight 318.73 g/mol. IUPAC: 3,4,5-tribromo-1,2-thiazole.
Chemical Property Profile of Isothiazole, tribromo-
Property Insights of Isothiazole, tribromo-
The XLogP value of 3.4306 indicates that Isothiazole, tribromo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, Isothiazole, tribromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isothiazole, tribromo- has 0 hydrogen bond donor(s) and 2 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 Isothiazole, tribromo-?
The CAS number of Isothiazole, tribromo- is 71091-87-7.
What is the molecular formula of Isothiazole, tribromo-?
The molecular formula of Isothiazole, tribromo- is C3Br3NS.
What is the molecular weight of Isothiazole, tribromo-?
The molecular weight of Isothiazole, tribromo- is 318.73 g/mol.
Where can I buy Isothiazole, tribromo-?
You can request a quote for Isothiazole, tribromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isothiazole, tribromo-?
Yes, KEHONG BIO provides custom synthesis services for Isothiazole, tribromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.