307343-33-5
Product Name:
ethyl 2,7,7-trimethyl-4-(4-nitrophenyl)-5-oxo-6,8-dihydroquinoline-3-carboxylate
Formula:
C21H22N2O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 382.4 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 382.15287181 g/mol |
| Monoisotopic Mass | 382.15287181 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 621 |
| 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 |