871948-96-8
Product Name:
PENT-2-ENOIC ACID (2R,3S)-3-DIBENZYLAMINO-2-HYDROXY-4-PHENYLBUTYL ESTER
Formula:
C29H33NO3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 443.6 g/mol |
|---|---|
| XLogP3 | 5.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 13 |
| Exact Mass | 443.24604391 g/mol |
| Monoisotopic Mass | 443.24604391 g/mol |
| Topological Polar Surface Area | 49.8 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 539 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |