![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](/static/products/1005/1005679-23-1.webp)
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 451.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C20H20F3N5O2S |
|---|---|
| Molecular Weight | 451.13 g/mol |
| LogP | 3.50822 |
| Topological Polar Surface Area | 81.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.12897 |
| Heavy Atoms | 31 |
| Complexity | 1252.4448 |
Chemical Identifiers
| CAS Number | 1005679-23-1 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1NC(=O)CN4C(=CC(=N4)C(F)(F)F)C5CC5 |
Product Overview
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), with molecular formula C20H20F3N5O2S and molecular weight 451.13 g/mol. IUPAC: 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.
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
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 3.50822 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 81.81 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 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 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 451.13 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO 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, KEHONG BIO 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.