330216-96-1
Product Name:
diethyl 3-hydroxy-3-methyl-3'-nitro-5-(p-tolylamino)-1,2,3,4-tetrahydro-[1,1'-biphenyl]-2,6-dicarboxylate
Formula:
C26H30N2O7
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COMPUTED DESCRIPTORS
| Molecular Weight | 482.5 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 9 |
| Exact Mass | 482.20530130 g/mol |
| Monoisotopic Mass | 482.20530130 g/mol |
| Topological Polar Surface Area | 131 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 815 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |