478246-57-0
Product Name:
METHYL 4-(4-[2,6-DINITRO-4-(TRIFLUOROMETHYL)PHENYL]PIPERAZINO)-3-NITROBENZENECARBOXYLATE
Formula:
C19H16F3N5O8
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COMPUTED DESCRIPTORS
Molecular Weight | 499.4 g/mol |
---|---|
XLogP3 | 3.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 13 |
Rotatable Bond Count | 4 |
Exact Mass | 499.09509697 g/mol |
Monoisotopic Mass | 499.09509697 g/mol |
Topological Polar Surface Area | 170 Ų |
Heavy Atom Count | 35 |
Formal Charge | 0 |
Complexity | 797 |
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 |