![4-Methyl-7-nitrobenzo[1,2,5]thiadiazole structure](/static/products/232/2325-05-5.png)
4-Methyl-7-nitrobenzo[1,2,5]thiadiazole
TL;DR: 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole (CAS 2325-05-5) is a chemical compound with molecular formula C7H5N3O2S and molecular weight 195.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-methyl-4-nitro-2,1,3-benzothiadiazole
Also Known As: 4-methyl-7-nitro-2,1,3-benzothiadiazole, 4-methyl-7-nitrobenzo-2,1,3-thiadiazole, 4-methyl-7-nitrobenzo[1,2,5]thiadiazole, 7-methyl-4-nitro-2,1,3-benzothiadiazole, 4-methyl-7-nitro-benzo[1,2,5]thiadiazole
| Molecular Formula | C7H5N3O2S |
|---|---|
| Molecular Weight | 195.01 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 99.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 195.01025 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 2325-05-5 |
|---|---|
| SMILES | CC1=CC=C(C2=NSN=C12)[N+](=O)[O-] |
| InChIKey | NTZTXANDSQZDAO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-7-nitrobenzo[1,2,5]thiadiazole (CAS 2325-05-5), with molecular formula C7H5N3O2S and molecular weight 195.01 g/mol. IUPAC: 7-methyl-4-nitro-2,1,3-benzothiadiazole.
Chemical Property Profile of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole
Property Insights of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole. The TPSA of 99.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole. Following Lipinski's Rule of Five, 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole has 0 hydrogen bond donor(s) and 5 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 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole?
The CAS number of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole is 2325-05-5.
What is the molecular formula of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole?
The molecular formula of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole is C7H5N3O2S.
What is the molecular weight of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole?
The molecular weight of 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole is 195.01 g/mol.
Where can I buy 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole?
You can request a quote for 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-7-nitrobenzo[1,2,5]thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.