3-bromo-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)benzamide

3-bromo-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)benzamide

Formula: C15H11BrN2O3S2

SMILES: CS(=O)(=O)C1=CC=C2N=C(NC(=O)C3=CC(Br)=CC=C3)SC2=C1

IUPAC: 3-bromo-N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)benzamide

InChI: InChI=1S/C15H11BrN2O3S2/c1-23(20,21)11-5-6-12-13(8-11)22-15(17-12)18-14(19)9-3-2-4-10(16)7-9/h2-8H,1H3,(H,17,18,19)

Composition: C (43.81%), H (2.70%), Br (19.43%), N (6.81%), O (11.67%), S (15.59%)

Molar Mass: 411.29

Atom Count: 34

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	409.939448
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	VJRZIESEIYZYNA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.76
Topological Polar Surface Area	76.13
Polarizability	37.07
Ring Count	3
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C15H11BrN2O3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00