514193-99-8
Product Name:
5-(4-(tert-butyl)phenyl)-4-(4-chlorobenzoyl)-1-(4,6-dimethylbenzo[d]thiazol-2-yl)-3-hydroxy-1H-pyrrol-2(5H)-one
Formula:
C30H27ClN2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 531.1 g/mol |
|---|---|
| XLogP3 | 8.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 4 |
| Exact Mass | 530.1430916 g/mol |
| Monoisotopic Mass | 530.1430916 g/mol |
| Topological Polar Surface Area | 98.7 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 916 |
| 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 |