![2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide structure](/static/products/3132/313223-90-4.webp)
2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide
TL;DR: 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide (CAS 313223-90-4) is a chemical compound with molecular formula C11H9ClN4O3S2 and molecular weight 343.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide
Also Known As: 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide, F0509-2645, 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide, 2-chloro-N-(5-(ethylthio)-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide, 2-CHLORO-N-[5-(ETHYLSULFANYL)-1,3,4-THIADIAZOL-2-YL]-5-NITROBENZAMIDE
| Molecular Formula | C11H9ClN4O3S2 |
|---|---|
| Molecular Weight | 343.98 g/mol |
| LogP | 3.464 |
| Topological Polar Surface Area | 98.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.98047 |
| Heavy Atoms | 21 |
| Complexity | 691.8579 |
Chemical Identifiers
| CAS Number | 313223-90-4 |
|---|---|
| SMILES | CCSC1=NN=C(S1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl |
Product Overview
2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide (CAS 313223-90-4), with molecular formula C11H9ClN4O3S2 and molecular weight 343.98 g/mol. IUPAC: 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-5-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide
Property Insights of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide
The XLogP value of 3.464 indicates that 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide has 1 hydrogen bond donor(s) and 7 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-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide?
The CAS number of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide is 313223-90-4.
What is the molecular formula of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide?
The molecular formula of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide is C11H9ClN4O3S2.
What is the molecular weight of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide?
The molecular weight of 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide is 343.98 g/mol.
Where can I buy 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide?
You can request a quote for 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.