339097-12-0
Product Name:
2,4-DIOXO-1,3,4,6,7,11B-HEXAHYDRO-2H-PYRIDO[2,1-A]ISOQUINOLINE-3-CARBALDEHYDE O-[4-(TRIFLUOROMETHYL)BENZYL]OXIME
Formula:
C22H19F3N2O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 416.4 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 416.13477696 g/mol |
| Monoisotopic Mass | 416.13477696 g/mol |
| Topological Polar Surface Area | 59 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 673 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |