1-(4-bromobenzenesulfonyl)-N-(2,6-dimethylphenyl)piperidine-4-carboxamide

1-(4-bromobenzenesulfonyl)-N-(2,6-dimethylphenyl)piperidine-4-carboxamide

Formula: C20H23BrN2O3S

SMILES: CC1=CC=CC(C)=C1NC(=O)C1CCN(CC1)S(=O)(=O)C1=CC=C(Br)C=C1

IUPAC: 1-(4-bromobenzenesulfonyl)-N-(2,6-dimethylphenyl)piperidine-4-carboxamide

InChI: InChI=1S/C20H23BrN2O3S/c1-14-4-3-5-15(2)19(14)22-20(24)16-10-12-23(13-11-16)27(25,26)18-8-6-17(21)7-9-18/h3-9,16H,10-13H2,1-2H3,(H,22,24)

Composition: C (53.22%), H (5.14%), Br (17.70%), N (6.21%), O (10.63%), S (7.10%)

Molar Mass: 451.38

Atom Count: 50

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	450.061277
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NPTAISYZBYZIHL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.37
Topological Polar Surface Area	66.48
Polarizability	43.02
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H23BrN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00