371126-46-4
Product Name:
methyl 4-(3-cyano-4-phenyl-6-thiophen-2-ylpyridin-2-yl)sulfanyl-3-oxobutanoate
Formula:
C21H16N2O3S2
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 408.5 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 408.06023472 g/mol |
| Monoisotopic Mass | 408.06023472 g/mol |
| Topological Polar Surface Area | 134 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 600 |
| 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 |