866137-44-2
Product Name:
Methyl 3-nitro-4-(4-([(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)amino]carbonyl)piperazino)benzenecarboxylate
Formula:
C21H21N5O7
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COMPUTED DESCRIPTORS
| Molecular Weight | 455.4 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 455.14409803 g/mol |
| Monoisotopic Mass | 455.14409803 g/mol |
| Topological Polar Surface Area | 146 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 767 |
| 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 |