302559-79-1
Product Name:
N-[4-(5-Methylbenzothiazol-2-yl)phenyl]-3,5-dinitrobenzamide
Formula:
C21H14N4O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 434.4 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 434.06849073 g/mol |
| Monoisotopic Mass | 434.06849073 g/mol |
| Topological Polar Surface Area | 162 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 668 |
| 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 |