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2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione structure
Fine Chemical

2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione

TL;DR: 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione (CAS 1022251-81-5) is a chemical compound with molecular formula C21H17ClF3N3O2 and molecular weight 435.09613 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethylidene]indene-1,3-dione

Also Known As: 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione, 2-((4-(3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDYL)PIPERAZINYL)ETHYLIDENE)INDANE-1,3-DIONE, 2-(1-{4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}ethylidene)-2,3-dihydro-1H-indene-1,3-dione, 2-(1-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}ethylidene)-1H-indene-1,3(2H)-dione, 2-[1-[4-[3-chloro-5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]ethylidene]indane-1,3-dione

CAS Number
1022251-81-5
Molecular Formula
C21H17ClF3N3O2
Molecular Weight
435.09613 g/mol
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Technical Specifications

Molecular FormulaC21H17ClF3N3O2
Molecular Weight435.09613 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)53.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors8
Rotatable Bonds2
Exact Mass435.09613 Da
Heavy Atoms30
Complexity707.0
SMILESCC(=C1C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)C4=C(C=C(C=N4)C(F)(F)F)Cl
InChIKeyHTRVSEMXVINUBO-UHFFFAOYSA-N

Chemical Property Profile of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione

XLogP
4.5
TPSA (Topological Polar Surface Area)
53.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
2
Heavy Atoms
30
Complexity
707.0
Exact Mass
435.09613
Monoisotopic Mass
435.09613
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione

The XLogP value of 4.5 indicates that 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione?

The CAS number of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione is 1022251-81-5.

What is the molecular formula of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione?

The molecular formula of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione is C21H17ClF3N3O2.

What is the molecular weight of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione?

The molecular weight of 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione is 435.09613 g/mol.

Where can I buy 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione?

You can request a quote for 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione?

Yes, CoreyChem provides custom synthesis services for 2-[1-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethylidene]indene-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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