339276-32-3
Product Name:
1-[2,6-DINITRO-4-(TRIFLUOROMETHYL)PHENYL]-N-([3-(4-METHOXYPHENYL)-2-METHYLTETRAHYDRO-5-ISOXAZOLYL]METHYL)-4-PIPERIDINECARBOXAMIDE
Formula:
C25H28F3N5O7
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COMPUTED DESCRIPTORS
Molecular Weight | 567.5 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 12 |
Rotatable Bond Count | 6 |
Exact Mass | 567.19408274 g/mol |
Monoisotopic Mass | 567.19408274 g/mol |
Topological Polar Surface Area | 146 Ų |
Heavy Atom Count | 40 |
Formal Charge | 0 |
Complexity | 877 |
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 |