Name: Name:1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridine
Brand: Angene
SKU: AG00IGSE
Rating: 90 (10 reviews)

1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridine

CAS No.:

916176-50-6

Catalog Number:

AG00IGSE

Molecular Formula:

C20H23BN2O4S

Molecular Weight:

398.2836

Catalog Number:

AG00IGSE

Chemical Name:

1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridine

CAS Number:

916176-50-6

Molecular Formula:

C20H23BN2O4S

Molecular Weight:

398.2836

MDL Number:

MFCD09953957

IUPAC Name:

1-(4-methylphenyl)sulfonyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridine

InChI:

InChI=1S/C20H23BN2O4S/c1-14-6-8-15(9-7-14)28(24,25)23-13-11-16-17(10-12-22-18(16)23)21-26-19(2,3)20(4,5)27-21/h6-13H,1-5H3

InChI Key:

HGLJGFMGEOLFQL-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)S(=O)(=O)n1ccc2c1nccc2B1OC(C(O1)(C)C)(C)C

Complexity:

669

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

398.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

398.284g/mol

Monoisotopic Mass:

398.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: