N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(2-fluorophenyl)methanesulfonamide

N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(2-fluorophenyl)methanesulfonamide

Formula: C20H24FN3O3S

SMILES: CS(=O)(=O)N(CC(=O)N1CCN(CC2=CC=CC=C2)CC1)C1=CC=CC=C1F

IUPAC: N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-N-(2-fluorophenyl)methanesulfonamide

InChI: InChI=1S/C20H24FN3O3S/c1-28(26,27)24(19-10-6-5-9-18(19)21)16-20(25)23-13-11-22(12-14-23)15-17-7-3-2-4-8-17/h2-10H,11-16H2,1H3

Composition: C (59.24%), H (5.97%), F (4.69%), N (10.36%), O (11.84%), S (7.91%)

Molar Mass: 405.49

Atom Count: 52

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	405.152240982
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	YIZHKGVHNWXFAE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	106.22
Topological Polar Surface Area	60.93
Polarizability	41.65
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H24FN3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00