477853-60-4
Product Name:
Methyl 3-((2-cyano-3-[(ethoxycarbonyl)amino]-3-oxo-1-propenyl)amino)-2-thiophenecarboxylate
Formula:
C13H13N3O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 323.33 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 323.05759170 g/mol |
| Monoisotopic Mass | 323.05759170 g/mol |
| Topological Polar Surface Area | 146 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 525 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |