1-Methylindazole-3-boronic Acid Pinacol Ester - CAS 1627722-97-7
Catalog: |
BB011899 |
Product Name: |
1-Methylindazole-3-boronic Acid Pinacol Ester |
CAS: |
1627722-97-7 |
Synonyms: |
1-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole; 1-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole |
IUPAC Name: | 1-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole |
Description: | 1-Methylindazole-3-boronic Acid Pinacol Ester (CAS# 1627722-97-7) is a useful research chemical. |
Molecular Weight: | 258.12 |
Molecular Formula: | C14H19N2O2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=NN(C3=CC=CC=C23)C |
InChI: | InChI=1S/C14H19BN2O2/c1-13(2)14(3,4)19-15(18-13)12-10-8-6-7-9-11(10)17(5)16-12/h6-9H,1-5H3 |
InChI Key: | OZGVUTRIDUMWJT-UHFFFAOYSA-N |
LogP: | 1.87250 |
Publication Number | Title | Priority Date |
US-2019292188-A1 | Imidazopyrimidines and triazolopyrimidines as a2a / a2b inhibitors | 20180227 |
IL-276873-D0 | Midazopyrimidines and triazolopyrimidines as a2a / a2b inhibitors | 20180227 |
KR-20200139153-A | Imidazopyrimidine and triazolopyrimidine as A2A/A2B inhibitors | 20180227 |
BR-112020017421-A2 | IMIDAZOPYRIMIDINES AND TRIAZOLOPYRIMIDINES AS A2A / A2B INHIBITORS | 20180227 |
CN-112384515-A | Imidazopyrimidines and triazolopyrimidines as A2A/A2B inhibitors | 20180227 |
Complexity: | 345 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.153958 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.153958 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 36.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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