861210-70-0
Product Name:
4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-METHYL-1,3,4-BENZOXADIAZEPIN-5(4H)-ONE
Formula:
C15H9ClF3N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 355.70 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 1 |
Exact Mass | 355.0335387 g/mol |
Monoisotopic Mass | 355.0335387 g/mol |
Topological Polar Surface Area | 54.8 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 529 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |