2-(4-bromo-2-methylphenoxy)-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

2-(4-bromo-2-methylphenoxy)-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

Formula: C20H23BrN2O4S

SMILES: CC1=CC(Br)=CC=C1OCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N1CCCCC1

IUPAC: 2-(4-bromo-2-methylphenoxy)-N-[4-(piperidine-1-sulfonyl)phenyl]acetamide

InChI: InChI=1S/C20H23BrN2O4S/c1-15-13-16(21)5-10-19(15)27-14-20(24)22-17-6-8-18(9-7-17)28(25,26)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,24)

Composition: C (51.40%), H (4.96%), Br (17.10%), N (5.99%), O (13.69%), S (6.86%)

Molar Mass: 467.38

Atom Count: 51

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	466.056191
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	JBXKOUZLMUBFOV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	113.64
Topological Polar Surface Area	75.71
Polarizability	43.82
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H23BrN2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00