Ethyl 3-cyclopropyl-1-(4-methoxyphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylate - CAS 1245807-76-4
Catalog: |
BB053356 |
Product Name: |
Ethyl 3-cyclopropyl-1-(4-methoxyphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylate |
CAS: |
1245807-76-4 |
Synonyms: |
ethyl3-cyclopropyl-1-(4-methoxyphenyl)-6-oxo-6,7-dihydro-1H-pyrazolo[3,4-b]pyridine-4-carboxylate |
IUPAC Name: | ethyl 3-cyclopropyl-1-(4-methoxyphenyl)-6-oxo-7H-pyrazolo[3,4-b]pyridine-4-carboxylate |
Molecular Weight: | 353.4 |
Molecular Formula: | C19H19N3O4 |
Canonical SMILES: | CCOC(=O)C1=CC(=O)NC2=C1C(=NN2C3=CC=C(C=C3)OC)C4CC4 |
InChI: | InChI=1S/C19H19N3O4/c1-3-26-19(24)14-10-15(23)20-18-16(14)17(11-4-5-11)21-22(18)12-6-8-13(25-2)9-7-12/h6-11H,3-5H2,1-2H3,(H,20,23) |
InChI Key: | SGJCKGFEANSWRN-UHFFFAOYSA-N |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 596 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 353.1375561 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 353.1375561 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 82.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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