1-(1-Boc-4-piperidyl)-3-methylpyrazole-4-boronic Acid Pinacol Ester - CAS 1092563-68-2
Catalog: |
BB002421 |
Product Name: |
1-(1-Boc-4-piperidyl)-3-methylpyrazole-4-boronic Acid Pinacol Ester |
CAS: |
1092563-68-2 |
Synonyms: |
4-[3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester; tert-butyl 4-[3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate |
IUPAC Name: | tert-butyl 4-[3-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]piperidine-1-carboxylate |
Description: | 1-(1-Boc-4-piperidyl)-3-methylpyrazole-4-boronic Acid Pinacol Ester (CAS# 1092563-68-2) is a useful research chemical. |
Molecular Weight: | 391.31 |
Molecular Formula: | C20H34N3O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2C)C3CCN(CC3)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C20H34BN3O4/c1-14-16(21-27-19(5,6)20(7,8)28-21)13-24(22-14)15-9-11-23(12-10-15)17(25)26-18(2,3)4/h13,15H,9-12H2,1-8H3 |
InChI Key: | CEDVIMODHITMNP-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
LogP: | 3.00060 |
Publication Number | Title | Priority Date |
TW-202100520-A | Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190305 |
US-2021017156-A1 | Pyrazolyl pyrimidinylamine compounds as cdk2 inhibitors | 20190305 |
AU-2008315746-A1 | Pyridine and pyrazine derivatives useful in the treatment of cell proliferative disorders | 20071025 |
CA-2703653-A1 | Pyridine and pyrazine derivatives -083 | 20071025 |
EP-2215085-A2 | Pyridine and pyrazine derivatives useful in the treatment of cell proliferative disorders | 20071025 |
Complexity: | 569 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 391.2642367 |
Formal Charge: | 0 |
Heavy Atom Count: | 28 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 391.2642367 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 65.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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