1-(2-{N-[(4-fluorophenyl)methyl]-4-chlorobenzenesulfonamido}acetyl)piperidine-4-carboxamide

1-(2-{N-[(4-fluorophenyl)methyl]-4-chlorobenzenesulfonamido}acetyl)piperidine-4-carboxamide

Formula: C21H23ClFN3O4S

SMILES: NC(=O)C1CCN(CC1)C(=O)CN(CC1=CC=C(F)C=C1)S(=O)(=O)C1=CC=C(Cl)C=C1

IUPAC: 1-(2-{N-[(4-fluorophenyl)methyl]-4-chlorobenzenesulfonamido}acetyl)piperidine-4-carboxamide

InChI: InChI=1S/C21H23ClFN3O4S/c22-17-3-7-19(8-4-17)31(29,30)26(13-15-1-5-18(23)6-2-15)14-20(27)25-11-9-16(10-12-25)21(24)28/h1-8,16H,9-14H2,(H2,24,28)

Composition: C (53.90%), H (4.95%), Cl (7.58%), F (4.06%), N (8.98%), O (13.68%), S (6.85%)

Molar Mass: 467.94

Atom Count: 54

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	467.1081833
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	LJEVCTCBWTWLGF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.55
Topological Polar Surface Area	100.78
Polarizability	45.12
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H23ClFN3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00