![2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone structure](/static/products/7247/724757-18-0.webp)
2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
TL;DR: 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone (CAS 724757-18-0) is a chemical compound with molecular formula C11H9N3O3S2 and molecular weight 295.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
Also Known As: CBKinase1_008763, CBKinase1_021163, 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone, BRD-K47029212-001-01-1, 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]-1-(4-nitrophenyl)ethanone
| Molecular Formula | C11H9N3O3S2 |
|---|---|
| Molecular Weight | 295.01 g/mol |
| LogP | 2.72972 |
| Topological Polar Surface Area | 85.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.00854 |
| Heavy Atoms | 19 |
| Complexity | 609.9029 |
Chemical Identifiers
| CAS Number | 724757-18-0 |
|---|---|
| SMILES | CC1=NN=C(S1)SCC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone (CAS 724757-18-0), with molecular formula C11H9N3O3S2 and molecular weight 295.01 g/mol. IUPAC: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone.
Chemical Property Profile of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
Property Insights of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone
The XLogP value of 2.72972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone. The TPSA of 85.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone. Following Lipinski's Rule of Five, 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone has 0 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-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone?
The CAS number of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone is 724757-18-0.
What is the molecular formula of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone?
The molecular formula of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone is C11H9N3O3S2.
What is the molecular weight of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone?
The molecular weight of 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone is 295.01 g/mol.
Where can I buy 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone?
You can request a quote for 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5-Methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(4-nitrophenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.