312935-05-0
Product Name:
5-(4-METHOXYPHENYL)-7-TRIFLUOROMETHYL-4,5,6,7-TETRAHYDROPYRAZOLO[1,5-A]PYRIMIDINE-2-CARBOXYLIC ACID
Formula:
C15H14F3N3O3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 48.9 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 341.28 g/mol |
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XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 3 |
Exact Mass | 341.09872580 g/mol |
Monoisotopic Mass | 341.09872580 g/mol |
Topological Polar Surface Area | 76.4 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 469 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |