338755-77-4
Product Name:
(3-[(BENZOYLOXY)METHYL]-4-OXO-3,4-DIHYDRO-2H-THIOCHROMEN-3-YL)METHYL BENZENECARBOXYLATE
Formula:
C25H20O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 432.5 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 8 |
| Exact Mass | 432.10314491 g/mol |
| Monoisotopic Mass | 432.10314491 g/mol |
| Topological Polar Surface Area | 95 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 616 |
| 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 |