369393-44-2
Product Name:
dimethyl 2-(2-(2,5-dimethylphenoxy)acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Formula:
C21H23NO6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 417.5 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 417.12460863 g/mol |
| Monoisotopic Mass | 417.12460863 g/mol |
| Topological Polar Surface Area | 119 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 628 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |