844460-57-7
Product Name:
methyl 2-(5-{(E)-2-cyano-2-[4-(furan-2-yl)-1,3-thiazol-2-yl]ethenyl}furan-2-yl)benzoate
Formula:
C22H14N2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 402.4 g/mol |
|---|---|
| XLogP3 | 4.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 402.06742811 g/mol |
| Monoisotopic Mass | 402.06742811 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 675 |
| 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 |