77409-56-4
Product Name:
3-ETHYL-5-(1-METHYL-PYRIDIN-2-YLIDENE)-4-OXO-2-THIOXO-OXAZOLE
Formula:
C11H12N2O2S
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COMPUTED DESCRIPTORS
Molecular Weight | 236.29 g/mol |
---|---|
XLogP3 | 2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 1 |
Exact Mass | 236.06194880 g/mol |
Monoisotopic Mass | 236.06194880 g/mol |
Topological Polar Surface Area | 64.9 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 437 |
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 |