4-[2-(N-cyclohexyl-4-bromobenzenesulfonamido)acetamido]benzamide

4-[2-(N-cyclohexyl-4-bromobenzenesulfonamido)acetamido]benzamide

Formula: C21H24BrN3O4S

SMILES: NC(=O)C1=CC=C(NC(=O)CN(C2CCCCC2)S(=O)(=O)C2=CC=C(Br)C=C2)C=C1

IUPAC: 4-[2-(N-cyclohexyl-4-bromobenzenesulfonamido)acetamido]benzamide

InChI: InChI=1S/C21H24BrN3O4S/c22-16-8-12-19(13-9-16)30(28,29)25(18-4-2-1-3-5-18)14-20(26)24-17-10-6-15(7-11-17)21(23)27/h6-13,18H,1-5,14H2,(H2,23,27)(H,24,26)

Composition: C (51.02%), H (4.89%), Br (16.16%), N (8.50%), O (12.94%), S (6.48%)

Molar Mass: 494.4

Atom Count: 54

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	493.06709
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	HNHISXIZIILDKY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	120.09
Topological Polar Surface Area	109.57
Polarizability	46.08
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H24BrN3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00