477853-81-9
Product Name:
N-[3-(TRIFLUOROMETHYL)PHENYL]-3A,11C-DIHYDRO-3H-BENZO[5,6]CHROMENO[4,3-C]ISOXAZOLE-1(4H)-CARBOXAMIDE
Formula:
C22H17F3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 414.4 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 414.11912689 g/mol |
| Monoisotopic Mass | 414.11912689 g/mol |
| Topological Polar Surface Area | 50.8 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 646 |
| 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 |