339023-62-0
Product Name:
3-(2-[4-(TERT-BUTYL)ANILINO]-1-NITROVINYL)-2-BENZOFURAN-1(3H)-ONE
Formula:
C20H20N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 352.4 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 352.14230712 g/mol |
| Monoisotopic Mass | 352.14230712 g/mol |
| Topological Polar Surface Area | 84.2 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 567 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |