1H-Indazole-5-boronic Acid
Product Information
Molecular Formula
C7H7N2O2B
Molecular Weight
161.95
Description
Reactant for: Preparation of thieno[3,2-d]pyrimidines as Tpl2 kinase inhibitors; Synthesis of pyridinyl benzonaphthyridinones as mTOR inhibitors for the treatment of cancer; Novel bisphosphonate inhibitors of human farnesyl pyrophosphate synthase; Preparation of diazabicycloheptanes as α7 neurinal nicotinic receptor affectors; Preparation of pyrazolopyrimidinamine derivatives with tyrosine and phosphinositide kinase inhibitory activity.
Synonyms
1H-indazol-5-ylboronic acid; 1H-indazol-5-ylboronic acid
IUPAC Name
1H-indazol-5-ylboronic acid
SMILES
B(C1=CC2=C(C=C1)NN=C2)(O)O
InChI
InChI=1S/C7H7BN2O2/c11-8(12)6-1-2-7-5(3-6)4-9-10-7/h1-4,11-12H,(H,9,10)
InChI Key
CLVPGJWAMIADSY-UHFFFAOYSA-N
Boiling Point
457.012 °C at 760 mmHg
Melting Point
175-180 °C
Flash Point
Not applicable
Purity
≥ 95 %
Density
1.423 g/cm3
Appearance
Solid
LogP
-0.75730
Safety Information
Hazards
H302
Precautionary Statement
P264, P270, P301+P312, P330, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
162.0600576 g/mol
Monoisotopic Mass
162.0600576 g/mol
Topological Polar Surface Area
69.1Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
168
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
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2021216757-A1 | Rna-binding protein multimerization inhibitors and methods of use thereof | 2020-04-21 |
| WO-2021125229-A1 | Indazole compound or salt thereof, and pharmaceutical composition | 2019-12-17 |
| WO-2021102569-A1 | Cannabinoid derivatives | 2019-11-26 |
| WO-2021088787-A1 | Quinazoline compound used as axl inhibitor | 2019-11-07 |
| CN-110642880-A | Preparation method of nitrogen unsubstituted pyrazole and indazole boric acid | 2019-10-11 |
| CN-110642880-B | Preparation method of nitrogen unsubstituted pyrazole and indazole boric acid | 2019-10-11 |
| CA-3092828-A1 | Compounds, compositions, and methods for suppressing toxic endoplasmic reticulum stress | 2018-03-01 |
| US-2021040091-A1 | Compounds, compositions, and methods for suppressing toxic endoplasmic reticulum stress | 2018-03-01 |
| JP-2021518856-A | Compounds, compositions, and methods for controlling toxic endoplasmic reticulum stress | 2018-03-01 |
| CA-3087807-A1 | Inhibitors of indoleamine 2,3-dioxygenase and/or tryptophan 2,3-dioxygenase | 2018-01-15 |
