446276-02-4
Product Name:
METHYL 2-(4-CHLOROPHENYL)-1-OXO-1,2-DIHYDRO-4-ISOQUINOLINECARBOXYLATE
Formula:
C17H12ClNO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 313.7 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 313.0505709 g/mol |
| Monoisotopic Mass | 313.0505709 g/mol |
| Topological Polar Surface Area | 46.6 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 482 |
| 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 |