321998-77-0
Product Name:
4-(2-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]AMINO)ETHYL)-4-AZATRICYCLO[5.2.1.0(2,6)]DEC-8-ENE-3,5-DIONE
Formula:
C17H15ClF3N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 385.8 g/mol |
---|---|
XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 4 |
Exact Mass | 385.0804889 g/mol |
Monoisotopic Mass | 385.0804889 g/mol |
Topological Polar Surface Area | 62.3 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 611 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 4 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |