836638-10-9
Product Name:
ethyl 2-(3-(4-(allyloxy)benzoyl)-4-hydroxy-5-oxo-2-(thiophen-2-yl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate
Formula:
C25H22N2O6S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 510.6 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 9 |
| Exact Mass | 510.09192877 g/mol |
| Monoisotopic Mass | 510.09192877 g/mol |
| Topological Polar Surface Area | 163 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 872 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |