530127-30-1
Product Name:
3,5-DIBROMO-2-[[[(3-NITROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula:
C15H9Br2N3O5S
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 503.1 g/mol |
---|---|
XLogP3 | 4.3 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 3 |
Exact Mass | 502.86092 g/mol |
Monoisotopic Mass | 500.86297 g/mol |
Topological Polar Surface Area | 156 Ų |
Heavy Atom Count | 26 |
Formal Charge | 0 |
Complexity | 588 |
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 |