897046-09-2
Product Name:
Alanine, N-(3,5-dimethyl-4-isoxazolylsulfonyl)- (5CI)
Formula:
C8H12N2O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 248.26 g/mol |
|---|---|
| XLogP3 | 0.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 248.04669266 g/mol |
| Monoisotopic Mass | 248.04669266 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 363 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |