317833-18-4
Product Name:
3A,11C-DIHYDRO-3H-BENZO[5,6]CHROMENO[4,3-C]ISOXAZOL-1(4H)-YL(3,4-DICHLOROPHENYL)METHANONE
Formula:
C21H15Cl2NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 400.3 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 1 |
| Exact Mass | 399.0428987 g/mol |
| Monoisotopic Mass | 399.0428987 g/mol |
| Topological Polar Surface Area | 38.8 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 576 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |