154140-55-3
Product Name:
DL-LUCIFERIN (FIREFLY) 1-(4,5-DIMETHOXY-2-NITROPHENYL)ETHYL ESTER
Formula:
C21H19N3O7S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 489.5 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 7 |
| Exact Mass | 489.06644230 g/mol |
| Monoisotopic Mass | 489.06644230 g/mol |
| Topological Polar Surface Area | 190 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 767 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |