957000-61-2
Product Name:
(2S)-2-(2-((3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy)propanamido)-4-(methylthio)butanoic acid
Formula:
C19H23NO6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 393.5 g/mol |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 393.12460863 g/mol |
| Monoisotopic Mass | 393.12460863 g/mol |
| Topological Polar Surface Area | 127 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 619 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |