1354484-82-4
Product Name:
(2S,4S)-4-(2-BROMO-4-CHLOROPHENOXY)-1-(TERT-BUTOXYCARBONYL)-2-PYRROLIDINECARBOXYLIC ACID
Formula:
C16H19BrClNO5
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COMPUTED DESCRIPTORS
| Molecular Weight | 420.7 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 419.01351 g/mol |
| Monoisotopic Mass | 419.01351 g/mol |
| Topological Polar Surface Area | 76.1 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 484 |
| 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 |