N-(4-{4-[(4-bromophenyl)amino]piperidin-1-ylsulfonyl}phenyl)acetamide

N-(4-{4-[(4-bromophenyl)amino]piperidin-1-ylsulfonyl}phenyl)acetamide

Formula: C19H22BrN3O3S

SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N1CCC(CC1)NC1=CC=C(Br)C=C1

IUPAC: N-[4-({4-[(4-bromophenyl)amino]piperidin-1-yl}sulfonyl)phenyl]acetamide

InChI: InChI=1S/C19H22BrN3O3S/c1-14(24)21-16-6-8-19(9-7-16)27(25,26)23-12-10-18(11-13-23)22-17-4-2-15(20)3-5-17/h2-9,18,22H,10-13H2,1H3,(H,21,24)

Composition: C (50.45%), H (4.90%), Br (17.66%), N (9.29%), O (10.61%), S (7.09%)

Molar Mass: 452.37

Atom Count: 49

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	451.056526
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	SAHOALGAEMSQNP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.21
Topological Polar Surface Area	78.51
Polarizability	42.5
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H22BrN3O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00