76201-90-6
Product Name:
1-(4-CHLOROPHENYL)-6,7-DIMETHOXY-3,4-DIHYDROISOQUINOLINE
Formula:
C17H16ClNO2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 41.5 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 301.8 g/mol |
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XLogP3 | 3.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 301.0869564 g/mol |
Monoisotopic Mass | 301.0869564 g/mol |
Topological Polar Surface Area | 30.8 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 379 |
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 |