![7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE structure](/static/products/1048/1048915-59-8.webp)
7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE
TL;DR: 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE (CAS 1048915-59-8) is a chemical compound with molecular formula C20H26F3N3O3S and molecular weight 445.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,7-dimethyl-1-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]sulfonylmethyl]bicyclo[2.2.1]heptan-2-one
Also Known As: 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE, 7,7-dimethyl-1-[({4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}sulfonyl)methyl]bicyclo[2.2.1]heptan-2-one, 7,7-Dimethyl-1-[[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]sulfonylmethyl]bicyclo[2.2.1]heptan-2-one, 7,7-dimethyl-1-[({4-[5-(trifluoromethyl)-2-pyridinyl]piperazino}sulfonyl)methyl]bicyclo[2.2.1]heptan-2-one, 7,7-Dimethyl-1-[[[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]sulfonyl]methyl]bicyclo[2.2.1]heptan-2-one
| Molecular Formula | C20H26F3N3O3S |
|---|---|
| Molecular Weight | 445.16 g/mol |
| LogP | 2.9476 |
| Topological Polar Surface Area | 70.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.1647 |
| Heavy Atoms | 30 |
| Complexity | 938.2836 |
Chemical Identifiers
| CAS Number | 1048915-59-8 |
|---|---|
| SMILES | CC1(C2CCC1(C(=O)C2)CS(=O)(=O)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F)C |
Product Overview
7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE (CAS 1048915-59-8), with molecular formula C20H26F3N3O3S and molecular weight 445.16 g/mol. IUPAC: 7,7-dimethyl-1-[[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]sulfonylmethyl]bicyclo[2.2.1]heptan-2-one.
Chemical Property Profile of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE
Property Insights of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE
The XLogP value of 2.9476 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE. The TPSA of 70.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE. Following Lipinski's Rule of Five, 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE has 0 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 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE?
The CAS number of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE is 1048915-59-8.
What is the molecular formula of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE?
The molecular formula of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE is C20H26F3N3O3S.
What is the molecular weight of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE?
The molecular weight of 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE is 445.16 g/mol.
Where can I buy 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE?
You can request a quote for 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE?
Yes, KEHONG BIO provides custom synthesis services for 7,7-DIMETHYL-1-(((4-(5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)SULFONYL)METHYL)BICYCLO[2.2.1]HEPTAN-2-ONE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.