318517-16-7
Product Name:
N3-(TERT-BUTYL)-N2-(3-CHLOROPHENYL)-3,4-DIHYDRO-2,3(1H)-ISOQUINOLINEDICARBOXAMIDE
Formula:
C21H24ClN3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 385.9 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 385.1557047 g/mol |
| Monoisotopic Mass | 385.1557047 g/mol |
| Topological Polar Surface Area | 61.4 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 548 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |