339276-55-0
Product Name:
N-(1,5,6,10B-TETRAHYDRO-2H-ISOXAZOLO[3,2-A]ISOQUINOLIN-2-YLMETHYL)-1-(6-CHLORO-3-PYRIDAZINYL)-4-PIPERIDINECARBOXAMIDE
Formula:
C22H26ClN5O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 427.9 g/mol |
---|---|
XLogP3 | 2.9 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 427.1775028 g/mol |
Monoisotopic Mass | 427.1775028 g/mol |
Topological Polar Surface Area | 70.6 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 602 |
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 |