77169-77-8
Product Name:
5-Isoquinolinamine, 3-(methoxymethyl)-N-(4,4a,5,10-tetrahydro-1H,3H-(1 ,3)thiazino(3,4-b)isoquinolin-1-ylidene)-, (+-)-
Formula:
C23H23N3OS
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COMPUTED DESCRIPTORS
Molecular Weight | 389.5 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 389.15618354 g/mol |
Monoisotopic Mass | 389.15618354 g/mol |
Topological Polar Surface Area | 63 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 570 |
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 |