439107-98-9
Product Name:
(5-BROMO-1-BENZOTHIOPHEN-2-YL)(MORPHOLINO)METHANONE
Formula:
C13H12BrNO2S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 45.8 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 326.21 g/mol |
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XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 1 |
Exact Mass | 324.97721 g/mol |
Monoisotopic Mass | 324.97721 g/mol |
Topological Polar Surface Area | 57.8 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 322 |
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 |