![2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile structure](/static/products/371/371129-70-3.png)
2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile
TL;DR: 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile (CAS 371129-70-3) is a chemical compound with molecular formula C13H8N4O2S3 and molecular weight 347.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetonitrile
Also Known As: 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile, (5-{[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]methyl}-1,3-thiazol-2-yl)acetonitrile, 2-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetonitrile
| Molecular Formula | C13H8N4O2S3 |
|---|---|
| Molecular Weight | 347.98 g/mol |
| LogP | 4.01938 |
| Topological Polar Surface Area | 92.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.98093 |
| Heavy Atoms | 22 |
| Complexity | 880.918 |
Chemical Identifiers
| CAS Number | 371129-70-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)SCC3=CN=C(S3)CC#N |
Product Overview
2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile (CAS 371129-70-3), with molecular formula C13H8N4O2S3 and molecular weight 347.98 g/mol. IUPAC: 2-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanylmethyl]-1,3-thiazol-2-yl]acetonitrile.
Chemical Property Profile of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile
Property Insights of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile
The XLogP value of 4.01938 indicates that 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile. Following Lipinski's Rule of Five, 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile has 0 hydrogen bond donor(s) and 8 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-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile?
The CAS number of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile is 371129-70-3.
What is the molecular formula of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile?
The molecular formula of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile is C13H8N4O2S3.
What is the molecular weight of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile?
The molecular weight of 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile is 347.98 g/mol.
Where can I buy 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile?
You can request a quote for 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-(((6-nitrobenzo[d]thiazol-2-yl)thio)methyl)thiazol-2-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.