1005123-60-3
Product Name:
4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-5-(4-METHOXYPHENYL)-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-1,3-CYCLOHEXANEDIONE
Formula:
C28H24ClF3N2O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 528.9 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 528.1427548 g/mol |
| Monoisotopic Mass | 528.1427548 g/mol |
| Topological Polar Surface Area | 68.3 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 834 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |