76870-16-1
Product Name:
2-(4-((((4-(Chloromethyl)phenyl)amino)thioxomethyl)amino)phenoxy)-N,N- dicyclohexylacetamide
Formula:
C28H36ClN3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 514.1 g/mol |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 513.2216763 g/mol |
| Monoisotopic Mass | 513.2216763 g/mol |
| Topological Polar Surface Area | 85.7 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 635 |
| 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 |