845899-58-3
Product Name:
methyl 4-((E)-((E)-2-(1-cyano-2-oxo-2-(m-tolylamino)ethylidene)-4-oxo-3-phenylthiazolidin-5-ylidene)methyl)benzoate
Formula:
C28H21N3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 495.5 g/mol |
|---|---|
| XLogP3 | 5.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 495.12527733 g/mol |
| Monoisotopic Mass | 495.12527733 g/mol |
| Topological Polar Surface Area | 125 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 967 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |