897835-69-7
Product Name:
5-(4-butoxy-3-ethoxyphenyl)-1-(5-((2,4-dichlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)-3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1H-pyrrol-2(5H)-one
Formula:
C35H33Cl2N3O6S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 726.7 g/mol |
|---|---|
| XLogP3 | 8.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 12 |
| Exact Mass | 725.1187835 g/mol |
| Monoisotopic Mass | 725.1187835 g/mol |
| Topological Polar Surface Area | 165 Ų |
| Heavy Atom Count | 48 |
| Formal Charge | 0 |
| Complexity | 1170 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |