![1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone structure](/static/products/332/332860-93-2.png)
1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone
TL;DR: 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone (CAS 332860-93-2) is a chemical compound with molecular formula C10H8N4O3S2 and molecular weight 296.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl]ethanone
Also Known As: 1-{4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone, 1-(4-((5-amino-1,3,4-thiadiazol-2-yl)thio)-3-nitrophenyl)ethanone, 1-[4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl]ethanone
| Molecular Formula | C10H8N4O3S2 |
|---|---|
| Molecular Weight | 296.00 g/mol |
| LogP | 2.3823 |
| Topological Polar Surface Area | 112.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.00378 |
| Heavy Atoms | 19 |
| Complexity | 655.97437 |
Chemical Identifiers
| CAS Number | 332860-93-2 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)SC2=NN=C(S2)N)[N+](=O)[O-] |
Product Overview
1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone (CAS 332860-93-2), with molecular formula C10H8N4O3S2 and molecular weight 296.00 g/mol. IUPAC: 1-[4-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl]ethanone.
Chemical Property Profile of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone
Property Insights of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone
The XLogP value of 2.3823 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone. The TPSA of 112.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone. Following Lipinski's Rule of Five, 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone has 1 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 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone?
The CAS number of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone is 332860-93-2.
What is the molecular formula of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone?
The molecular formula of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone is C10H8N4O3S2.
What is the molecular weight of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone?
The molecular weight of 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone is 296.00 g/mol.
Where can I buy 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone?
You can request a quote for 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-{4-[(5-Amino-1,3,4-thiadiazol-2-yl)sulfanyl]-3-nitrophenyl}ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.