866039-66-9
Product Name:
2-(2-[4-(1,3-BENZODIOXOL-5-YLMETHYL)PIPERAZINO]ETHYL)-7-NITRO-2H-1,4-BENZOXAZIN-3(4H)-ONE
Formula:
C22H24N4O6
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COMPUTED DESCRIPTORS
| Molecular Weight | 440.4 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 440.16958450 g/mol |
| Monoisotopic Mass | 440.16958450 g/mol |
| Topological Polar Surface Area | 109 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 682 |
| 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 |