872624-60-7
Product Name:
1H-1-Benzazepine-1-carboxylic acid, 2,3,4,5-tetrahydro-5-hydroxy-7-Methyl-8-(trifluoroMethyl)-, 1,1-diMethylethyl ester, (5R)-
Formula:
C17H22F3NO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 345.36 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 345.15517805 g/mol |
| Monoisotopic Mass | 345.15517805 g/mol |
| Topological Polar Surface Area | 49.8 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 461 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |