339100-61-7
Product Name:
ETHYL 1,2-DIAMINO-4-[4-(BENZYLOXY)PHENYL]-5-CYANO-6-OXO-1,6-DIHYDRO-3-PYRIDINECARBOXYLATE
Formula:
C22H20N4O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 404.4 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 404.14845513 g/mol |
| Monoisotopic Mass | 404.14845513 g/mol |
| Topological Polar Surface Area | 132 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 780 |
| 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 |