361367-90-0
Product Name:
methyl 4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)benzoate
Formula:
C18H16N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 324.3 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 324.11100700 g/mol |
| Monoisotopic Mass | 324.11100700 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 674 |
| 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 |