478246-67-2
Product Name:
METHYL 4-(4-[2-(4-BROMOPHENYL)-2-OXOETHYL]PIPERAZINO)-3-NITROBENZENECARBOXYLATE
Formula:
C20H20BrN3O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 462.3 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 461.05863 g/mol |
| Monoisotopic Mass | 461.05863 g/mol |
| Topological Polar Surface Area | 95.7 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 597 |
| 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 |