2-[N-(4-methoxyphenyl)-4-fluorobenzenesulfonamido]-N-{2-methyl-4-[(phenylsulfanyl)methyl]phenyl}acetamide

2-[N-(4-methoxyphenyl)-4-fluorobenzenesulfonamido]-N-{2-methyl-4-[(phenylsulfanyl)methyl]phenyl}acetamide

Formula: C29H27FN2O4S2

SMILES: COC1=CC=C(C=C1)N(CC(=O)NC1=CC=C(CSC2=CC=CC=C2)C=C1C)S(=O)(=O)C1=CC=C(F)C=C1

IUPAC: 2-[N-(4-methoxyphenyl)-4-fluorobenzenesulfonamido]-N-{2-methyl-4-[(phenylsulfanyl)methyl]phenyl}acetamide

InChI: InChI=1S/C29H27FN2O4S2/c1-21-18-22(20-37-26-6-4-3-5-7-26)8-17-28(21)31-29(33)19-32(24-11-13-25(36-2)14-12-24)38(34,35)27-15-9-23(30)10-16-27/h3-18H,19-20H2,1-2H3,(H,31,33)

Composition: C (63.25%), H (4.94%), F (3.45%), N (5.09%), O (11.62%), S (11.64%)

Molar Mass: 550.66

Atom Count: 65

Heavy Atom Count: 38

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	550.139627868
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	YWPXZYAKLQMLKM-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	151.29
Topological Polar Surface Area	75.71
Polarizability	58.08
Ring Count	4
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C29H27FN2O4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00