338774-70-2
Product Name:
4-(6-BROMO-3-HYDROXY-4-OXO-3,4-DIHYDRO-2-QUINAZOLINYL)BENZENECARBONITRILE
Formula:
C15H8BrN3O2
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 18.1 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 342.15 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 1 |
| Exact Mass | 340.97999 g/mol |
| Monoisotopic Mass | 340.97999 g/mol |
| Topological Polar Surface Area | 76.7 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 504 |
| 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 |