1-(4-Chlorobenzyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide - CAS 938006-72-5
Catalog: |
BB049130 |
Product Name: |
1-(4-Chlorobenzyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide |
CAS: |
938006-72-5 |
Synonyms: |
1-[(4-chlorophenyl)methyl]-3,6-dimethylpyrazolo[5,4-b]pyridine-4-carbohydrazide; 1H-Pyrazolo[3,4-b]pyridine-4-carboxylic acid, 1-[(4-chlorophenyl)methyl]-3,6-dimethyl-, hydrazide; 1-[(4-chlorophenyl)methyl]-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide |
IUPAC Name: | 1-[(4-chlorophenyl)methyl]-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carbohydrazide |
Description: | 1-(4-Chlorobenzyl)-3,6-dimethyl-1H-pyrazolo[3,4-b]pyridine-4-carbohydrazide (CAS# 938006-72-5 ) is a useful research chemical. |
Molecular Weight: | 329.78 |
Molecular Formula: | C16H16ClN5O |
Canonical SMILES: | CC1=CC(=C2C(=NN(C2=N1)CC3=CC=C(C=C3)Cl)C)C(=O)NN |
InChI: | InChI=1S/C16H16ClN5O/c1-9-7-13(16(23)20-18)14-10(2)21-22(15(14)19-9)8-11-3-5-12(17)6-4-11/h3-7H,8,18H2,1-2H3,(H,20,23) |
InChI Key: | VPMQOZWAUIKRCV-UHFFFAOYSA-N |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 429 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 329.1043378 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 329.1043378 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 85.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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