303995-22-4
Product Name:
N-(4-CHLOROPHENYL)-1-OXO-2-(3-PYRIDINYLMETHYL)-1,2-DIHYDRO-4-ISOQUINOLINECARBOXAMIDE
Formula:
C22H16ClN3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 389.8 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 389.0931045 g/mol |
| Monoisotopic Mass | 389.0931045 g/mol |
| Topological Polar Surface Area | 62.3 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 615 |
| 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 |