2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole
TL;DR: 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole (CAS 353256-57-2) is a chemical compound with molecular formula C9H6N4O4S2 and molecular weight 297.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4-dinitrophenyl)sulfanyl-5-methyl-1,3,4-thiadiazole
Also Known As: 2-({2,4-bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole, AI-204/31687035, 2-(2,4-dinitrophenyl)sulfanyl-5-methyl-1,3,4-thiadiazole, 1-(5-methyl(1,3,4-thiadiazol-2-ylthio))-2,4-dinitrobenzene
| Molecular Formula | C9H6N4O4S2 |
|---|---|
| Molecular Weight | 297.98 g/mol |
| LogP | 2.81412 |
| Topological Polar Surface Area | 112.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 297.98303 |
| Heavy Atoms | 19 |
| Complexity | 657.4192 |
Chemical Identifiers
| CAS Number | 353256-57-2 |
|---|---|
| SMILES | CC1=NN=C(S1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole (CAS 353256-57-2), with molecular formula C9H6N4O4S2 and molecular weight 297.98 g/mol. IUPAC: 2-(2,4-dinitrophenyl)sulfanyl-5-methyl-1,3,4-thiadiazole.
Chemical Property Profile of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole
Property Insights of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole
The XLogP value of 2.81412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole. The TPSA of 112.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole. Following Lipinski's Rule of Five, 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole 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-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole?
The CAS number of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole is 353256-57-2.
What is the molecular formula of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole?
The molecular formula of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole is C9H6N4O4S2.
What is the molecular weight of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole?
The molecular weight of 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole is 297.98 g/mol.
Where can I buy 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole?
You can request a quote for 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-({2,4-Bisnitrophenyl}sulfanyl)-5-methyl-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.