4-Chloro-7-(phenylsulfonyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[2,3-d]pyrimidine

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Catalog Number

ACMA00014867

Product Name

4-Chloro-7-(phenylsulfonyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-7H-pyrrolo[2,3-d]pyrimidine

Category

Salt

IUPAC Name

7-(benzenesulfonyl)-4-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-d]pyrimidine

Molecular Weight

419.7g/mol

Molecular Formula

C18H19BClN3O4S

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)N=CN=C3Cl

InChI

InChI=1S/C18H19BClN3O4S/c1-17(2)18(3,4)27-19(26-17)14-10-13-15(20)21-11-22-16(13)23(14)28(24,25)12-8-6-5-7-9-12/h5-11H,1-4H3

InChI Key

ZKQYIEUZLLKOPZ-UHFFFAOYSA-N

Complexity

679

Covalently-Bonded Unit Count

Exact Mass

419.087785g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

419.087785g/mol

Rotatable Bond Count

MSDS

COA

Spec Sheet

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