84332-28-5
Product Name:
5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-4-methoxy -2-methyl-, maleate, hydrate (2:3:2)
Formula:
2C19H24N4O2.3C4H4O4.2H2O
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COMPUTED DESCRIPTORS
Molecular Weight | 1029.1 g/mol |
---|---|
Hydrogen Bond Donor Count | 8 |
Hydrogen Bond Acceptor Count | 22 |
Rotatable Bond Count | 18 |
Exact Mass | 1028.41272786 g/mol |
Monoisotopic Mass | 1028.41272786 g/mol |
Topological Polar Surface Area | 359 Ų |
Heavy Atom Count | 74 |
Formal Charge | 0 |
Complexity | 547 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 3 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 5 |
Compound Is Canonicalized | Yes |