958396-69-5
Product Name:
2-Propenoic acid, 2-cyano-3-[4-(dimethylamino)phenyl]-, 3-[[[1-[(7-methoxy-2-oxo-2H-1-benzopyran-3-yl)carbonyl]-4-piperidinyl]carbonyl]amino]propyl ester
Formula:
C32H34N4O7
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COMPUTED DESCRIPTORS
Molecular Weight | 586.6 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 11 |
Exact Mass | 586.24274944 g/mol |
Monoisotopic Mass | 586.24274944 g/mol |
Topological Polar Surface Area | 138 Ų |
Heavy Atom Count | 43 |
Formal Charge | 0 |
Complexity | 1140 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |