957046-43-4
Product Name:
(R)-3-(benzylthio)-2-(3-(3-(tert-butyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)propanoic acid
Formula:
C29H31NO6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 521.6 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 10 |
| Exact Mass | 521.18720888 g/mol |
| Monoisotopic Mass | 521.18720888 g/mol |
| Topological Polar Surface Area | 131 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 889 |
| 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 |