477852-93-0
Product Name:
N-ALLYL-2-((6-OXO-1-[3-(TRIFLUOROMETHYL)BENZYL]-1,6-DIHYDRO-3-PYRIDINYL)CARBONYL)-1-HYDRAZINECARBOTHIOAMIDE
Formula:
C18H17F3N4O2S
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COMPUTED DESCRIPTORS
Molecular Weight | 410.4 g/mol |
---|---|
XLogP3 | 2.3 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 5 |
Exact Mass | 410.10243146 g/mol |
Monoisotopic Mass | 410.10243146 g/mol |
Topological Polar Surface Area | 106 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 691 |
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 |