866134-81-8
Product Name:
Ethyl 6-(2-methoxy-2-oxoethyl)-4-([3-(trifluoromethyl)phenyl]sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate
Formula:
C21H20F3NO7S
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COMPUTED DESCRIPTORS
| Molecular Weight | 487.4 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 8 |
| Exact Mass | 487.09125764 g/mol |
| Monoisotopic Mass | 487.09125764 g/mol |
| Topological Polar Surface Area | 108 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 814 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |