1009695-46-8
Product Name:
2-(2-CHLORO-BENZOYL)-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACID
Formula:
C17H14ClNO3
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COMPUTED DESCRIPTORS
| Molecular Weight | 315.7 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 315.0662210 g/mol |
| Monoisotopic Mass | 315.0662210 g/mol |
| Topological Polar Surface Area | 57.6 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 442 |
| 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 |