338753-45-0
Product Name:
3-(4-BROMOPHENYL)-5-[(DIMETHYLAMINO)METHYLENE]-1LAMBDA6,3-THIAZOLANE-1,1,4-TRIONE
Formula:
C12H13BrN2O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 345.21 g/mol |
---|---|
XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 2 |
Exact Mass | 343.98303 g/mol |
Monoisotopic Mass | 343.98303 g/mol |
Topological Polar Surface Area | 66.1 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 488 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |