433970-69-5
Product Name:
2-[[[(3-BROMO-4-METHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula:
C16H13BrN2O4S
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COMPUTED DESCRIPTORS
Molecular Weight | 409.3 g/mol |
---|---|
XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 407.97794 g/mol |
Monoisotopic Mass | 407.97794 g/mol |
Topological Polar Surface Area | 120 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 491 |
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 |