Name: Name:2-chloro-1-[4-(2-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one
Brand: Angene
SKU: AG01DWUT
Rating: 90 (10 reviews)

2-chloro-1-[4-(2-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one

CAS No.:

923204-90-4

Catalog Number:

AG01DWUT

Molecular Formula:

C12H14ClFN2O3S

Molecular Weight:

320.7676

Catalog Number:

AG01DWUT

Chemical Name:

2-chloro-1-[4-(2-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one

CAS Number:

923204-90-4

Molecular Formula:

C12H14ClFN2O3S

Molecular Weight:

320.7676

MDL Number:

MFCD08444099

IUPAC Name:

2-chloro-1-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

InChI:

InChI=1S/C12H14ClFN2O3S/c13-9-12(17)15-5-7-16(8-6-15)20(18,19)11-4-2-1-3-10(11)14/h1-4H,5-9H2

InChI Key:

GRQUYYHAXFLTMJ-UHFFFAOYSA-N

SMILES:

ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccccc1F

Complexity:

446

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

320.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

320.763g/mol

Monoisotopic Mass:

320.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1