312939-42-7
Product Name:
2-[(4-bromoanilino)(phenyl)methylene]-1-benzothiophen-3(2H)-one
Formula:
C21H14BrNOS
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COMPUTED DESCRIPTORS
| Molecular Weight | 408.3 g/mol |
|---|---|
| XLogP3 | 6.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 406.99795 g/mol |
| Monoisotopic Mass | 406.99795 g/mol |
| Topological Polar Surface Area | 60.8 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 471 |
| 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 |