Name: Name:1-[4-(4-acetylbenzenesulfonyl)piperazin-1-yl]-2-chloroethan-1-one
Brand: Angene
SKU: AG019PA6
Rating: 90 (10 reviews)

1-[4-(4-acetylbenzenesulfonyl)piperazin-1-yl]-2-chloroethan-1-one

CAS No.:

879319-23-0

Catalog Number:

AG019PA6

Molecular Formula:

C14H17ClN2O4S

Molecular Weight:

344.8138

Catalog Number:

AG019PA6

Chemical Name:

1-[4-(4-acetylbenzenesulfonyl)piperazin-1-yl]-2-chloroethan-1-one

CAS Number:

879319-23-0

Molecular Formula:

C14H17ClN2O4S

Molecular Weight:

344.8138

MDL Number:

MFCD08444116

IUPAC Name:

1-[4-(4-acetylphenyl)sulfonylpiperazin-1-yl]-2-chloroethanone

InChI:

InChI=1S/C14H17ClN2O4S/c1-11(18)12-2-4-13(5-3-12)22(20,21)17-8-6-16(7-9-17)14(19)10-15/h2-5H,6-10H2,1H3

InChI Key:

YZUSWKLRHVBLTM-UHFFFAOYSA-N

SMILES:

ClCC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(=O)C

Complexity:

516

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

344.06g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

344.81g/mol

Monoisotopic Mass:

344.06g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6