4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
TL;DR: 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide (CAS 710976-24-2) is a chemical compound with molecular formula C13H14N4O5S2 and molecular weight 370.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
Also Known As: 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide, 4-methoxy-N-{5-[(2-methoxyethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-nitrobenzamide, 4-methoxy-N-{5-[(2-methoxyethyl)thio]-1,3,4-thiadiazol-2-yl}-3-nitrobenzamide, N-[5-(2-methoxyethylthio)(1,3,4-thiadiazol-2-yl)](4-methoxy-3-nitrophenyl)carb oxamide
| Molecular Formula | C13H14N4O5S2 |
|---|---|
| Molecular Weight | 370.04 g/mol |
| LogP | 2.4457 |
| Topological Polar Surface Area | 116.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 370.04056 |
| Heavy Atoms | 24 |
| Complexity | 736.90216 |
Chemical Identifiers
| CAS Number | 710976-24-2 |
|---|---|
| SMILES | COCCSC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-] |
Product Overview
4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide (CAS 710976-24-2), with molecular formula C13H14N4O5S2 and molecular weight 370.04 g/mol. IUPAC: 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide.
Chemical Property Profile of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
Property Insights of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide
The XLogP value of 2.4457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide. The TPSA of 116.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide. Following Lipinski's Rule of Five, 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide has 1 hydrogen bond donor(s) and 9 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-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide?
The CAS number of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide is 710976-24-2.
What is the molecular formula of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide?
The molecular formula of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide is C13H14N4O5S2.
What is the molecular weight of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide?
The molecular weight of 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide is 370.04 g/mol.
Where can I buy 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide?
You can request a quote for 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methoxy-N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.