4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one
TL;DR: 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one (CAS 371199-95-0) is a chemical compound with molecular formula C19H16F6N4O and molecular weight 430.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1,1,1,3,3,3-hexafluoro-2-(pyridin-2-ylmethylamino)propan-2-yl]-5-methyl-2-phenyl-1H-pyrazol-3-one
Also Known As: 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one, 4-[1,1,1,3,3,3-hexafluoro-2-(pyridin-2-ylmethylamino)propan-2-yl]-5-methyl-2-phenyl-1H-pyrazol-3-one, 4-{1,1,1,3,3,3-hexafluoro-2-[(pyridin-2-ylmethyl)amino]propan-2-yl}-5-methyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
| Molecular Formula | C19H16F6N4O |
|---|---|
| Molecular Weight | 430.12 g/mol |
| LogP | 3.97872 |
| Topological Polar Surface Area | 62.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.12283 |
| Heavy Atoms | 30 |
| Complexity | 1040.614 |
Chemical Identifiers
| CAS Number | 371199-95-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=CC=C2)C(C(F)(F)F)(C(F)(F)F)NCC3=CC=CC=N3 |
Product Overview
4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one (CAS 371199-95-0), with molecular formula C19H16F6N4O and molecular weight 430.12 g/mol. IUPAC: 4-[1,1,1,3,3,3-hexafluoro-2-(pyridin-2-ylmethylamino)propan-2-yl]-5-methyl-2-phenyl-1H-pyrazol-3-one.
Chemical Property Profile of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one
Property Insights of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one
The XLogP value of 3.97872 indicates that 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one. Following Lipinski's Rule of Five, 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one has 2 hydrogen bond donor(s) and 3 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 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one?
The CAS number of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one is 371199-95-0.
What is the molecular formula of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular formula of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one is C19H16F6N4O.
What is the molecular weight of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one?
The molecular weight of 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one is 430.12 g/mol.
Where can I buy 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one?
You can request a quote for 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,1,1,3,3,3-hexafluoro-2-((pyridin-2-ylmethyl)amino)propan-2-yl)-5-methyl-2-phenyl-1H-pyrazol-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.