871949-01-8
Product Name:
HEXANOIC ACID (2S,3S)-3-DIBENZYLAMINO-2-HYDROXY-5-METHYLHEXYL ESTER
Formula:
C27H39NO3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 425.6 g/mol |
|---|---|
| XLogP3 | 6.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 15 |
| Exact Mass | 425.29299411 g/mol |
| Monoisotopic Mass | 425.29299411 g/mol |
| Topological Polar Surface Area | 49.8 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 449 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |