540512-86-5
Product Name:
N-{6-[(4,5-dicyano-2-nitrophenyl)amino]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide
Formula:
C22H18N6O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 446.5 g/mol |
|---|---|
| XLogP3 | 5.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 446.11610963 g/mol |
| Monoisotopic Mass | 446.11610963 g/mol |
| Topological Polar Surface Area | 176 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 810 |
| 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 |