532978-86-2
Product Name:
3,5-DIIODO-2-[[[(PHENYLACETYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula:
C16H12I2N2O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 566.2 g/mol |
---|---|
XLogP3 | 4.3 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 565.86581 g/mol |
Monoisotopic Mass | 565.86581 g/mol |
Topological Polar Surface Area | 111 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 486 |
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 |