3-bromo-N-{4-[(2,4-dimethylphenyl)sulfamoyl]phenyl}-4-methoxybenzamide

3-bromo-N-{4-[(2,4-dimethylphenyl)sulfamoyl]phenyl}-4-methoxybenzamide

Formula: C22H21BrN2O4S

SMILES: COC1=CC=C(C=C1Br)C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=CC=C(C)C=C1C

IUPAC: 3-bromo-N-{4-[(2,4-dimethylphenyl)sulfamoyl]phenyl}-4-methoxybenzamide

InChI: InChI=1S/C22H21BrN2O4S/c1-14-4-10-20(15(2)12-14)25-30(27,28)18-8-6-17(7-9-18)24-22(26)16-5-11-21(29-3)19(23)13-16/h4-13,25H,1-3H3,(H,24,26)

Composition: C (53.99%), H (4.33%), Br (16.33%), N (5.72%), O (13.08%), S (6.55%)

Molar Mass: 489.38

Atom Count: 51

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	488.040541
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	JAGYTBITKSWBJI-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	122.59
Topological Polar Surface Area	84.5
Polarizability	46.62
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H21BrN2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00