1354487-60-7
Product Name:
(2S,4S)-4-(4-BROMO-2-METHYLPHENOXY)-1-(TERT-BUTOXYCARBONYL)-2-PYRROLIDINECARBOXYLIC ACID
Formula:
C17H22BrNO5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 400.3 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 399.06814 g/mol |
| Monoisotopic Mass | 399.06814 g/mol |
| Topological Polar Surface Area | 76.1 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 478 |
| 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 |