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

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

Formula: C22H21F7N2O3S

SMILES: CCOC1=CC=CC=C1NC(=O)C1=C(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)SC2=C1CCC(C)C2

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

InChI: InChI=1/C22H21F7N2O3S/c1-3-34-14-7-5-4-6-13(14)30-17(32)16-12-9-8-11(2)10-15(12)35-18(16)31-19(33)20(23,24)21(25,26)22(27,28)29/h4-7,11H,3,8-10H2,1-2H3,(H,30,32)(H,31,33)

Composition: C (50.19%), H (4.02%), F (25.26%), N (5.32%), O (9.12%), S (6.09%)

Molar Mass: 526.47

Atom Count: 56

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	526.116110859
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	RTTAXMQNFSRIGC-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	116.25
Topological Polar Surface Area	67.43
Polarizability	41.67
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H21F7N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00