![1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one structure](/static/products/3390/339012-80-5.webp)
1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one
TL;DR: 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one (CAS 339012-80-5) is a chemical compound with molecular formula C19H17Cl2F3N4O3S and molecular weight 508.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one
Also Known As: 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one, 3-(3-chloro-2-thienyl)-3-oxopropanal O-(2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}-2-oxoethyl)oxime
| Molecular Formula | C19H17Cl2F3N4O3S |
|---|---|
| Molecular Weight | 508.04 g/mol |
| LogP | 4.3927 |
| Topological Polar Surface Area | 75.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 508.03506 |
| Heavy Atoms | 32 |
| Complexity | 1007.9444 |
Chemical Identifiers
| CAS Number | 339012-80-5 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C=C(C=N2)C(F)(F)F)Cl)C(=O)CON=CCC(=O)C3=C(C=CS3)Cl |
Product Overview
1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one (CAS 339012-80-5), with molecular formula C19H17Cl2F3N4O3S and molecular weight 508.04 g/mol. IUPAC: 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one.
Chemical Property Profile of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one
Property Insights of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one
The XLogP value of 4.3927 indicates that 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one. Following Lipinski's Rule of Five, 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one?
The CAS number of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one is 339012-80-5.
What is the molecular formula of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one?
The molecular formula of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one is C19H17Cl2F3N4O3S.
What is the molecular weight of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one?
The molecular weight of 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one is 508.04 g/mol.
Where can I buy 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one?
You can request a quote for 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-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-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-chlorothiophen-2-yl)-3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]-2-oxoethoxy]iminopropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.