1-(4-fluorobenzenesulfonyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine

1-(4-fluorobenzenesulfonyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine

Formula: C20H25FN2O5S

SMILES: COC1=CC(CN2CCN(CC2)S(=O)(=O)C2=CC=C(F)C=C2)=CC(OC)=C1OC

IUPAC: 1-(4-fluorobenzenesulfonyl)-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine

InChI: InChI=1S/C20H25FN2O5S/c1-26-18-12-15(13-19(27-2)20(18)28-3)14-22-8-10-23(11-9-22)29(24,25)17-6-4-16(21)5-7-17/h4-7,12-13H,8-11,14H2,1-3H3

Composition: C (56.59%), H (5.94%), F (4.48%), N (6.60%), O (18.85%), S (7.55%)

Molar Mass: 424.49

Atom Count: 54

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	424.14682125
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	ZYFMWFAHMIIYSD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	108.28
Topological Polar Surface Area	68.31
Polarizability	42.48
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H25FN2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00