30238-40-5
Product Name:
4H-Pyrido(1,2-a)pyrimidine-3-carboxylic acid, 1,6,7,8,9,9a-hexahydro-1 ,6-dimethyl-4-oxo-, ethyl ester
Formula:
C13H20N2O3
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COMPUTED DESCRIPTORS
Molecular Weight | 252.31 g/mol |
---|---|
XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 252.14739250 g/mol |
Monoisotopic Mass | 252.14739250 g/mol |
Topological Polar Surface Area | 49.8 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 392 |
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 |