3-bromo-N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-4-methoxybenzamide

3-bromo-N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-4-methoxybenzamide

Formula: C21H13BrCl2N2O3

SMILES: COC1=CC=C(C=C1Br)C(=O)NC1=CC=C2OC(=NC2=C1)C1=CC=C(Cl)C=C1Cl

IUPAC: 3-bromo-N-[2-(2,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-4-methoxybenzamide

InChI: InChI=1S/C21H13BrCl2N2O3/c1-28-18-6-2-11(8-15(18)22)20(27)25-13-4-7-19-17(10-13)26-21(29-19)14-5-3-12(23)9-16(14)24/h2-10H,1H3,(H,25,27)

Composition: C (51.25%), H (2.66%), Br (16.24%), Cl (14.41%), N (5.69%), O (9.75%)

Molar Mass: 492.15

Atom Count: 42

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	489.948661
Formal Charge	0
FSP3	0.05
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PAGUXSQRAWQUHK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	127.05
Topological Polar Surface Area	64.36
Polarizability	45.76
Ring Count	4
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H13BrCl2N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00