Name: Name:(3-fluoro-4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid
Brand: Angene
SKU: AG00ARAS
Rating: 90 (10 reviews)

(3-fluoro-4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid

CAS No.:

1447713-71-4

Catalog Number:

AG00ARAS

Molecular Formula:

C11H16BFN2O4S

Molecular Weight:

302.1301

Catalog Number:

AG00ARAS

Chemical Name:

(3-fluoro-4-((4-Methylpiperazin-1-yl)sulfonyl)phenyl)boronic acid

CAS Number:

1447713-71-4

Molecular Formula:

C11H16BFN2O4S

Molecular Weight:

302.1301

MDL Number:

MFCD28805500

IUPAC Name:

[3-fluoro-4-(4-methylpiperazin-1-yl)sulfonylphenyl]boronic acid

InChI:

InChI=1S/C11H16BFN2O4S/c1-14-4-6-15(7-5-14)20(18,19)11-3-2-9(12(16)17)8-10(11)13/h2-3,8,16-17H,4-7H2,1H3

InChI Key:

VCJDQZKWLFXGLF-UHFFFAOYSA-N

SMILES:

CN1CCN(CC1)S(=O)(=O)c1ccc(cc1F)B(O)O

Complexity:

423

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

302.091g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

302.127g/mol

Monoisotopic Mass:

302.091g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

89.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: