24223-70-9
Product Name:
2-[2-HYDROXY-1-(HYDROXYMETHYL)-2-(4-NITROPHENYL)ETHYL]-1H-ISOINDOLE-1,3(2H)-DIONE
Formula:
C17H14N2O6
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | >51.3 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 342.30 g/mol |
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XLogP3 | 1 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 342.08518617 g/mol |
Monoisotopic Mass | 342.08518617 g/mol |
Topological Polar Surface Area | 124 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 516 |
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 |