607687-95-6
Product Name:
1-(4,6-dimethylbenzo[d]thiazol-2-yl)-3-hydroxy-4-(3-methoxybenzoyl)-5-(3-nitrophenyl)-1H-pyrrol-2(5H)-one
Formula:
C27H21N3O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 515.5 g/mol |
|---|---|
| XLogP3 | 5.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 515.11510657 g/mol |
| Monoisotopic Mass | 515.11510657 g/mol |
| Topological Polar Surface Area | 154 Ų |
| Heavy Atom Count | 37 |
| Formal Charge | 0 |
| Complexity | 953 |
| 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 |