886500-99-8
Product Name:
(6,8-DIBROMO-3-ETHYL-4-OXO-3,4-DIHYDRO-QUINAZOLIN-2-YLSULFANYL)-ACETIC ACID
Formula:
C12H10Br2N2O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 422.09 g/mol |
---|---|
XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 421.87584 g/mol |
Monoisotopic Mass | 419.87789 g/mol |
Topological Polar Surface Area | 95.3 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 446 |
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 |