[4-(1-Ethyl-1H-pyrazol-4-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetic acid - CAS 1006477-62-8
Catalog: |
BB047544 |
Product Name: |
[4-(1-Ethyl-1H-pyrazol-4-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetic acid |
CAS: |
1006477-62-8 |
Synonyms: |
2-(4-(1-Ethyl-1H-pyrazol-4-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid; 2-[4-(1-ethylpyrazol-4-yl)-3-methylpyrazolo[5,4-b]pyridinyl]acetic acid |
IUPAC Name: | 2-[4-(1-ethylpyrazol-4-yl)-3-methylpyrazolo[3,4-b]pyridin-1-yl]acetic acid |
Description: | [4-(1-Ethyl-1H-pyrazol-4-yl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-1-yl]acetic acid (CAS# 1006477-62-8 ) is a useful research chemical. |
Molecular Weight: | 285.30 |
Molecular Formula: | C14H15N5O2 |
Canonical SMILES: | CCN1C=C(C=N1)C2=C3C(=NN(C3=NC=C2)CC(=O)O)C |
InChI: | InChI=1S/C14H15N5O2/c1-3-18-7-10(6-16-18)11-4-5-15-14-13(11)9(2)17-19(14)8-12(20)21/h4-7H,3,8H2,1-2H3,(H,20,21) |
InChI Key: | AUJTVKTUBYKDCG-UHFFFAOYSA-N |
Boiling Point: | 568.3±50.0 °C at 760 mmHg |
Purity: | 97 % |
Density: | 1.4±0.1 g/cm3 |
Complexity: | 394 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 285.12257474 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 285.12257474 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 85.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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