861206-88-4
Product Name:
2-(2-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]ETHYL)-2H-PYRIDO[3,2-B][1,4]OXAZIN-3(4H)-ONE
Formula:
C21H24N4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 396.4 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 396.17975526 g/mol |
| Monoisotopic Mass | 396.17975526 g/mol |
| Topological Polar Surface Area | 76.2 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 571 |
| 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 |