![3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone structure](/static/products/3214/321430-99-3.webp)
3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone
TL;DR: 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone (CAS 321430-99-3) is a chemical compound with molecular formula C10H9ClF3NOS and molecular weight 283.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]butan-2-one
Also Known As: 3-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone, 3-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl}butan-2-one, 1H-068, 3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylbutan-2-one, 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]butan-2-one
| Molecular Formula | C10H9ClF3NOS |
|---|---|
| Molecular Weight | 283.00 g/mol |
| LogP | 3.8234 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.00455 |
| Heavy Atoms | 17 |
| Complexity | 436.04947 |
Chemical Identifiers
| CAS Number | 321430-99-3 |
|---|---|
| SMILES | CC(C(=O)C)SC1=C(C=C(C=N1)C(F)(F)F)Cl |
Product Overview
3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone (CAS 321430-99-3), with molecular formula C10H9ClF3NOS and molecular weight 283.00 g/mol. IUPAC: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl]butan-2-one.
Chemical Property Profile of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone
Property Insights of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone
The XLogP value of 3.8234 indicates that 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.96 Ų, 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone has 0 hydrogen bond donor(s) and 3 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 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone?
The CAS number of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone is 321430-99-3.
What is the molecular formula of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone?
The molecular formula of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone is C10H9ClF3NOS.
What is the molecular weight of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone?
The molecular weight of 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone is 283.00 g/mol.
Where can I buy 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone?
You can request a quote for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone?
Yes, KEHONG BIO provides custom synthesis services for 3-{[3-Chloro-5-(trifluoromethyl)-2-pyridinyl]sulfanyl}-2-butanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.