1-Trityl-1H-pyrazole-4-boronic Acid Pinacol Ester - CAS 863238-73-7
Catalog: |
BB037886 |
Product Name: |
1-Trityl-1H-pyrazole-4-boronic Acid Pinacol Ester |
CAS: |
863238-73-7 |
Synonyms: |
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-(triphenylmethyl)pyrazole; 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tritylpyrazole |
IUPAC Name: | 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tritylpyrazole |
Description: | 1-Trityl-1H-pyrazole-4-boronic Acid Pinacol Ester (CAS# 863238-73-7) is a useful research chemical. |
Molecular Weight: | 436.35 |
Molecular Formula: | C28H29N2O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5 |
InChI: | InChI=1S/C28H29BN2O2/c1-26(2)27(3,4)33-29(32-26)25-20-30-31(21-25)28(22-14-8-5-9-15-22,23-16-10-6-11-17-23)24-18-12-7-13-19-24/h5-21H,1-4H3 |
InChI Key: | NJVKYFHOQLLDHU-UHFFFAOYSA-N |
Boiling Point: | 587.3 °C at 760 mmHg |
Density: | 1.07 g/cm3 |
MDL: | MFCD10698507 |
LogP: | 5.02250 |
Publication Number | Title | Priority Date |
WO-2021113492-A1 | Cyclic compounds and methods of using same | 20191206 |
US-2020347043-A1 | Modulators of the integrated stress pathway | 20190430 |
WO-2020223538-A1 | Substituted cycloalkyls as modulators of the integrated stress pathway | 20190430 |
BR-112020011979-A2 | amide-substituted indole compounds useful as tlr inhibitors | 20171219 |
BR-112020011775-A2 | (r) -5- (2- (2,5-difluorophenyl) pyrrolidin-1-yl) -3- (1h-pyrazol-1-yl) pyrazol [1,5-a] pyrimidine derivatives and related compounds as inhibitors trk kinase treatment for cancer | 20171215 |
Complexity: | 589 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 436.2322083000001 |
Formal Charge: | 0 |
Heavy Atom Count: | 33 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 436.2322083000001 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 36.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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