262844-52-0
Product Name:
5-((E)-[4-(BENZYLOXY)PHENYL]METHYLIDENE)-1,3-THIAZOLANE-2,4-DIONE
Formula:
C17H13NO3S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | <0.7 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 311.4 g/mol |
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XLogP3 | 3.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 4 |
Exact Mass | 311.06161445 g/mol |
Monoisotopic Mass | 311.06161445 g/mol |
Topological Polar Surface Area | 80.7 Ų |
Heavy Atom Count | 22 |
Formal Charge | 0 |
Complexity | 449 |
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 |