478079-16-2
Product Name:
METHYL 2-[1-(3,4-DIMETHOXYPHENETHYL)-4-HYDROXY-2-OXO-1,2-DIHYDRO-3-PYRIDINYL]ACETATE
Formula:
C18H21NO6
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | >52.1 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 347.4 g/mol |
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XLogP3 | 1.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 8 |
Exact Mass | 347.13688739 g/mol |
Monoisotopic Mass | 347.13688739 g/mol |
Topological Polar Surface Area | 85.3 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 556 |
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 |