185333-65-7
Product Name:
6-ALLYL-3-METHYL-4-PHENYLISOXAZOLO[3,4-D]PYRIDAZIN-7(6H)-ONE
Formula:
C15H13N3O2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 26.8 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 267.28 g/mol |
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XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 267.100776666 g/mol |
Monoisotopic Mass | 267.100776666 g/mol |
Topological Polar Surface Area | 58.7 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 429 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |