4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID
TL;DR: 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID (CAS 1024164-03-1) is a chemical compound with molecular formula C16H13F6N3O4 and molecular weight 425.08102 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2,2,3,3,4,4-hexafluoro-5-oxopentanoic acid
Also Known As: 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID, 5-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2,2,3,3,4,4-hexafluoro-5-oxopentanoic acid, 4-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamoyl]-2,2,3,3,4,4-hexafluoro-butanoic Acid, 5-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2,2,3,3,4,4-hexafluoro-5-oxo-pentanoic acid, C16H13F6N3O4
Technical Specifications
| Molecular Formula | C16H13F6N3O4 |
| Molecular Weight | 425.08102 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 90.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 425.08102 Da |
| Heavy Atoms | 29 |
| Complexity | 749.0 |
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(C(C(C(=O)O)(F)F)(F)F)(F)F |
| InChIKey | VLNWZGPQLIAQNQ-UHFFFAOYSA-N |
Chemical Property Profile of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID
Property Insights of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID
The XLogP value of 3.0 indicates that 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID. Following Lipinski's Rule of Five, 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID?
The CAS number of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID is 1024164-03-1.
What is the molecular formula of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID?
The molecular formula of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID is C16H13F6N3O4.
What is the molecular weight of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID?
The molecular weight of 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID is 425.08102 g/mol.
Where can I buy 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID?
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Does CoreyChem offer custom synthesis for 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID?
Yes, CoreyChem provides custom synthesis services for 4-(N-(2,3-DIMETHYL-5-OXO-1-PHENYL(3-PYRAZOLIN-4-YL))CARBAMOYL)-2,2,3,3,4,4-HEXAFLUOROBUTANOIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.