514189-58-3
Product Name:
methyl 4-(4-hydroxy-3-(4-methoxybenzoyl)-1-(6-methylbenzo[d]thiazol-2-yl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate
Formula:
C28H22N2O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 514.5 g/mol |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 514.11985760 g/mol |
| Monoisotopic Mass | 514.11985760 g/mol |
| Topological Polar Surface Area | 134 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 924 |
| 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 |