Name: Name:2-chloro-1-[4-(3-chloro-4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one
Brand: Angene
SKU: AG019PAC
Rating: 90 (10 reviews)

2-chloro-1-[4-(3-chloro-4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one

CAS No.:

923780-46-5

Catalog Number:

AG019PAC

Molecular Formula:

C12H13Cl2FN2O3S

Molecular Weight:

355.2126

Catalog Number:

AG019PAC

Chemical Name:

2-chloro-1-[4-(3-chloro-4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one

CAS Number:

923780-46-5

Molecular Formula:

C12H13Cl2FN2O3S

Molecular Weight:

355.2126

MDL Number:

MFCD08691087

IUPAC Name:

2-chloro-1-[4-(3-chloro-4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone

InChI:

InChI=1S/C12H13Cl2FN2O3S/c13-8-12(18)16-3-5-17(6-4-16)21(19,20)9-1-2-11(15)10(14)7-9/h1-2,7H,3-6,8H2

InChI Key:

NVWCSOOQJRVBJI-UHFFFAOYSA-N

SMILES:

ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(c(c1)Cl)F

Complexity:

477

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

354.001g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

355.205g/mol

Monoisotopic Mass:

354.001g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7