1-Isopropyl-2-methyl-1H-benzimidazole-6-boronic Acid Pinacol Ester - CAS 1873303-31-1
Catalog: |
BB014415 |
Product Name: |
1-Isopropyl-2-methyl-1H-benzimidazole-6-boronic Acid Pinacol Ester |
CAS: |
1873303-31-1 |
Synonyms: |
2-methyl-1-propan-2-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole; 2-methyl-1-propan-2-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole |
IUPAC Name: | 2-methyl-1-propan-2-yl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole |
Description: | 1-Isopropyl-2-methyl-1H-benzimidazole-6-boronic Acid Pinacol Ester (CAS# 1873303-31-1 ) is a useful research chemical. |
Molecular Weight: | 300.20 |
Molecular Formula: | C17H25N2O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=C(N3C(C)C)C |
InChI: | InChI=1S/C17H25BN2O2/c1-11(2)20-12(3)19-14-9-8-13(10-15(14)20)18-21-16(4,5)17(6,7)22-18/h8-11H,1-7H3 |
InChI Key: | MGNKQVFTRNWSFD-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
EP-3492462-A1 | Amino pyrimidine compound for inhibiting protein tyrosine kinase activity | 20160726 |
JP-2019522011-A | Aminopyrimidine compounds for inhibiting the activity of protein tyrosine kinases | 20160726 |
US-2019152954-A1 | Amino pyrimidine compound for inhibiting protein tyrosine kinase activity | 20160726 |
JP-2020183432-A | Aminopyrimidine compounds for inhibiting the activity of protein tyrosine kinases | 20160726 |
JP-6740452-B2 | Aminopyrimidine compounds for inhibiting the activity of protein tyrosine kinase | 20160726 |
Complexity: | 411 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 300.2009082 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 300.2009082 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 36.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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