6-(4-Boc-1-piperazinyl)pyridine-3-boronic acid pinacol ester

Name: 6-(4-Boc-1-piperazinyl)pyridine-3-boronic acid pinacol ester
SKU: ACM496786982
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Catalog NumberACM496786982

CAS Number496786-98-2

CategorySalt

IUPAC Name

tert-butyl 4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine-1-carboxylate

Molecular Weight

389.3g/mol

Molecular Formula

C20H32BN3O4

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H32BN3O4/c1-18(2,3)26-17(25)24-12-10-23(11-13-24)16-9-8-15(14-22-16)21-27-19(4,5)20(6,7)28-21/h8-9,14H,10-13H2,1-7H3

InChI Key

JWUBVPJWWYYRLJ-UHFFFAOYSA-N

Complexity

554

Covalently-Bonded Unit Count

Exact Mass

389.248587g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

389.248587g/mol

Rotatable Bond Count

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