866051-04-9
Product Name:
ETHYL 6-(ETHYLSULFONYL)-4-(2-THIENYLSULFONYL)-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-2-CARBOXYLATE
Formula:
C17H19NO7S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 445.5 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 445.03236547 g/mol |
| Monoisotopic Mass | 445.03236547 g/mol |
| Topological Polar Surface Area | 152 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 772 |
| 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 |