586391-44-8
Product Name:
3,5-DICHLORO-2-[[[(2-CHLORO-5-IODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula:
C15H8Cl3IN2O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 529.6 g/mol |
---|---|
XLogP3 | 5.6 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 527.83659 g/mol |
Monoisotopic Mass | 527.83659 g/mol |
Topological Polar Surface Area | 111 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 542 |
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 |