944805-36-1
Product Name:
Carbamic acid, N-(6-bromo-3-isoquinolinyl)-, 1,1-dimethylethyl ester
Formula:
C14H15BrN2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 323.18 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 322.03169 g/mol |
| Monoisotopic Mass | 322.03169 g/mol |
| Topological Polar Surface Area | 51.2 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 330 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |