337920-90-8
Product Name:
DIMETHYL 5-(4-BROMOPHENYL)-1H-PYRROLO[1,2-C][1,3]THIAZOLE-6,7-DICARBOXYLATE
Formula:
C16H14BrNO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 396.3 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 394.98269 g/mol |
| Monoisotopic Mass | 394.98269 g/mol |
| Topological Polar Surface Area | 82.8 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 469 |
| 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 |