332043-52-4
Product Name:
ethyl 2-(1-acetyl-7-ethoxy-2,2-dimethyl-3-thioxo-2,3-dihydro-4(1H)-quinolinylidene)-5-phenyl-1,3-dithiole-4-carboxylate
Formula:
C27H27NO4S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 525.7 g/mol |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 525.11022186 g/mol |
| Monoisotopic Mass | 525.11022186 g/mol |
| Topological Polar Surface Area | 139 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 935 |
| 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 |