2-bromo-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide

2-bromo-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide

Formula: C19H17BrN4O3S

SMILES: CC1=CC(C)=NC(NS(=O)(=O)C2=CC=C(NC(=O)C3=CC=CC=C3Br)C=C2)=N1

IUPAC: 2-bromo-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}benzamide

InChI: InChI=1S/C19H17BrN4O3S/c1-12-11-13(2)22-19(21-12)24-28(26,27)15-9-7-14(8-10-15)23-18(25)16-5-3-4-6-17(16)20/h3-11H,1-2H3,(H,23,25)(H,21,22,24)

Composition: C (49.47%), H (3.71%), Br (17.32%), N (12.14%), O (10.40%), S (6.95%)

Molar Mass: 461.33

Atom Count: 45

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	460.020475
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	SXAPWDALOXEYTP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.84
Topological Polar Surface Area	101.05
Polarizability	42.38
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H17BrN4O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00