900939-58-4
Product Name:
4-(4-NITROPHENYL)-1-((2,4,5-TRICHLOROPHENYL)SULFONYL)THIOSEMICARBAZIDE
Formula:
C13H9Cl3N4O4S2
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COMPUTED DESCRIPTORS
Molecular Weight | 455.7 g/mol |
---|---|
XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 453.913080 g/mol |
Monoisotopic Mass | 453.913080 g/mol |
Topological Polar Surface Area | 157 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 620 |
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 |