338776-93-5
Product Name:
4-[(ISOBUTYRYLOXY)IMINO]-3,4-DIHYDRO-1LAMBDA6-THIENO[2,3-B]THIOPYRAN-1,1(2H)-DIONE
Formula:
C11H13NO4S2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | >43.1 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 287.4 g/mol |
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XLogP3 | 2.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 3 |
Exact Mass | 287.02860024 g/mol |
Monoisotopic Mass | 287.02860024 g/mol |
Topological Polar Surface Area | 109 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 464 |
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 |