866134-62-5
Product Name:
ETHYL 6-CHLORO-4-([3-(TRIFLUOROMETHYL)PHENYL]SULFONYL)-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLATE
Formula:
C18H15ClF3NO5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 449.8 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 449.0311559 g/mol |
| Monoisotopic Mass | 449.0311559 g/mol |
| Topological Polar Surface Area | 81.3 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 699 |
| 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 |