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Product Name:
ETHYL 4-([4-(TERT-BUTYL)PHENYL]SULFONYL)-6-CHLORO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLATE
Formula:
C21H24ClNO5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 437.9 g/mol |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 437.1063717 g/mol |
| Monoisotopic Mass | 437.1063717 g/mol |
| Topological Polar Surface Area | 81.3 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 678 |
| 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 |