2-Iodobenzothiazole
TL;DR: 2-Iodobenzothiazole (CAS 1123-99-5) is a chemical compound with molecular formula C7H4INS and molecular weight 260.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-iodo-1,3-benzothiazole
Also Known As: 2-iodobenzothiazole, 2-IODOBENZO[D]THIAZOLE, 2-iodo-1,3-benzothiazole, daunorubicin, 2-Iodobenzodthiazole
| Molecular Formula | C7H4INS |
|---|---|
| Molecular Weight | 260.91 g/mol |
| LogP | 2.9009 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 260.91092 |
| Heavy Atoms | 10 |
| Complexity | 322.1336 |
Chemical Identifiers
| CAS Number | 1123-99-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)I |
Product Overview
2-Iodobenzothiazole (CAS 1123-99-5), with molecular formula C7H4INS and molecular weight 260.91 g/mol. IUPAC: 2-iodo-1,3-benzothiazole.
Chemical Property Profile of 2-Iodobenzothiazole
Property Insights of 2-Iodobenzothiazole
The XLogP value of 2.9009 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Iodobenzothiazole. With a topological polar surface area (TPSA) of 12.89 Ų, 2-Iodobenzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Iodobenzothiazole 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 2-Iodobenzothiazole?
The CAS number of 2-Iodobenzothiazole is 1123-99-5.
What is the molecular formula of 2-Iodobenzothiazole?
The molecular formula of 2-Iodobenzothiazole is C7H4INS.
What is the molecular weight of 2-Iodobenzothiazole?
The molecular weight of 2-Iodobenzothiazole is 260.91 g/mol.
Where can I buy 2-Iodobenzothiazole?
You can request a quote for 2-Iodobenzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Iodobenzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Iodobenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.