6505-58-4
Product Name:
2-(5-oxobenzo[4,5]phenaleno[1,9-bc]thien-2(5H)-ylidenebenzo[4,5]phenaleno[1,9-bc]thiophen-5(2H)-one
Formula:
C36H16O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 544.6 g/mol |
|---|---|
| XLogP3 | 8.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 0 |
| Exact Mass | 544.05917210 g/mol |
| Monoisotopic Mass | 544.05917210 g/mol |
| Topological Polar Surface Area | 84.7 Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 1070 |
| 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 |