871673-28-8
Product Name:
2,4-Thiophenedicarboxylic acid, 3-(bromomethyl)-5-[(2-thienylcarbonyl)amino]-, 2,4-dimethyl ester
Formula:
C14H12BrNO5S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.3 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 416.93403 g/mol |
| Monoisotopic Mass | 416.93403 g/mol |
| Topological Polar Surface Area | 138 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 478 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |