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5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide structure
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5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide

TL;DR: 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide (CAS 1005679-23-1) is a chemical compound with molecular formula C20H20F3N5O2S and molecular weight 451.12897 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide

Also Known As: 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide, 2-[5-cyclopropyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)acetamide

CAS Number
1005679-23-1
Molecular Formula
C20H20F3N5O2S
Molecular Weight
451.12897 g/mol
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Technical Specifications

Molecular FormulaC20H20F3N5O2S
Molecular Weight451.12897 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)108.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors8
Rotatable Bonds3
Exact Mass451.12897 Da
Heavy Atoms31
Complexity789.0
SMILESCC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1NC(=O)CN4C(=CC(=N4)C(F)(F)F)C5CC5
InChIKeyBQKPQGOWPUCSEV-UHFFFAOYSA-N

Chemical Property Profile of 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide

XLogP
3.3
TPSA (Topological Polar Surface Area)
108.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
3
Heavy Atoms
31
Complexity
789.0
Exact Mass
451.12897
Monoisotopic Mass
451.12897
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 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide

The XLogP value of 3.3 indicates that 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide. Following Lipinski's Rule of Five, 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide has 1 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 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide?

The CAS number of 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide is 1005679-23-1.

What is the molecular formula of 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide?

The molecular formula of 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide is C20H20F3N5O2S.

What is the molecular weight of 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide?

The molecular weight of 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide is 451.12897 g/mol.

Where can I buy 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide?

You can request a quote for 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide?

Yes, CoreyChem provides custom synthesis services for 5-Cyclopropyl-N-(5,6,7,8-tetrahydro-2-methyl-4-oxo[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-3-(trifluoromethyl)-1H-pyrazole-1-acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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