130793-28-1
Product Name:
(2S,3R,5S)-5-[(N-Formyl-L-leucyl)oxy]-2-hexyl-3-hydroxyhexadecanoic Acid (Orlistat Impurity)
Formula:
C29H55NO6
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 513.7 g/mol |
|---|---|
| XLogP3 | 9.2 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 25 |
| Exact Mass | 513.40293847 g/mol |
| Monoisotopic Mass | 513.40293847 g/mol |
| Topological Polar Surface Area | 113 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 568 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |