652976-27-7
Product Name:
(Z)-ETHYL 5-HYDROXY-8-OXO-8,9-DIHYDRO-7H-PYRIDO[2,3-B]AZEPINE-6-CARBOXYLATE
Formula:
C12H12N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 248.23 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 248.07970687 g/mol |
| Monoisotopic Mass | 248.07970687 g/mol |
| Topological Polar Surface Area | 88.5 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 392 |
| 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 |