311317-65-4
Product Name:
2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-1-(4-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
Formula:
C26H26N4O5
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 474.5 g/mol |
---|---|
XLogP3 | 4.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 4 |
Exact Mass | 474.19031994 g/mol |
Monoisotopic Mass | 474.19031994 g/mol |
Topological Polar Surface Area | 134 Ų |
Heavy Atom Count | 35 |
Formal Charge | 0 |
Complexity | 979 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |