2-(2-bromobenzamido)-N-(2-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

2-(2-bromobenzamido)-N-(2-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C24H23BrN2O3S

SMILES: CCOC1=CC=CC=C1NC(=O)C1=C(NC(=O)C2=CC=CC=C2Br)SC2=C1CCCC2

IUPAC: 2-(2-bromobenzamido)-N-(2-ethoxyphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1S/C24H23BrN2O3S/c1-2-30-19-13-7-6-12-18(19)26-23(29)21-16-10-4-8-14-20(16)31-24(21)27-22(28)15-9-3-5-11-17(15)25/h3,5-7,9,11-13H,2,4,8,10,14H2,1H3,(H,26,29)(H,27,28)

Composition: C (57.72%), H (4.64%), Br (16.00%), N (5.61%), O (9.61%), S (6.42%)

Molar Mass: 499.42

Atom Count: 54

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	498.061277
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	HHMILDGDRKPLIN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	129.65
Topological Polar Surface Area	67.43
Polarizability	47.83
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H23BrN2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00