799773-36-7
Product Name:
dimethyl (E)-5-((2-cyano-2-(4-(3,4-dimethylphenyl)thiazol-2-yl)vinyl)amino)isophthalate
Formula:
C24H21N3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 447.5 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 8 |
| Exact Mass | 447.12527733 g/mol |
| Monoisotopic Mass | 447.12527733 g/mol |
| Topological Polar Surface Area | 130 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 740 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |