![1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one structure](/static/products/5477/547721-98-2.webp)
1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one
TL;DR: 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one (CAS 547721-98-2) is a chemical compound with molecular formula C16H22N4O2S and molecular weight 334.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one
Also Known As: 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one, 3,3'-sulfanediylbis[1-(3,5-dimethyl-1H-pyrazol-1-yl)propan-1-one], 1-(3,5-dimethylpyrazolyl)-3-[3-(3,5-dimethylpyrazolyl)-3-oxopropylthio]propan- 1-one, 1-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-3-{[3-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-3-OXOPROPYL]SULFANYL}-1-PROPANONE, 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxo-propyl]sulfanyl-propan-1-one
| Molecular Formula | C16H22N4O2S |
|---|---|
| Molecular Weight | 334.15 g/mol |
| LogP | 2.80728 |
| Topological Polar Surface Area | 69.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.14636 |
| Heavy Atoms | 23 |
| Complexity | 657.4838 |
Chemical Identifiers
| CAS Number | 547721-98-2 |
|---|---|
| SMILES | CC1=CC(=NN1C(=O)CCSCCC(=O)N2C(=CC(=N2)C)C)C |
Product Overview
1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one (CAS 547721-98-2), with molecular formula C16H22N4O2S and molecular weight 334.15 g/mol. IUPAC: 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one.
Chemical Property Profile of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one
Property Insights of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one
The XLogP value of 2.80728 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one. The TPSA of 69.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one. Following Lipinski's Rule of Five, 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one has 0 hydrogen bond donor(s) and 5 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-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one?
The CAS number of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one is 547721-98-2.
What is the molecular formula of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one?
The molecular formula of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one is C16H22N4O2S.
What is the molecular weight of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one?
The molecular weight of 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one is 334.15 g/mol.
Where can I buy 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one?
You can request a quote for 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3,5-dimethylpyrazol-1-yl)-3-[3-(3,5-dimethylpyrazol-1-yl)-3-oxopropyl]sulfanylpropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.