6-tert-butyl-N-(4-chlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

6-tert-butyl-N-(4-chlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C28H38ClN3O2S

SMILES: CCC1CCCCN1CC(=O)NC1=C(C(=O)NC2=CC=C(Cl)C=C2)C2=C(CC(CC2)C(C)(C)C)S1

IUPAC: 6-tert-butyl-N-(4-chlorophenyl)-2-[2-(2-ethylpiperidin-1-yl)acetamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1/C28H38ClN3O2S/c1-5-21-8-6-7-15-32(21)17-24(33)31-27-25(26(34)30-20-12-10-19(29)11-13-20)22-14-9-18(28(2,3)4)16-23(22)35-27/h10-13,18,21H,5-9,14-17H2,1-4H3,(H,30,34)(H,31,33)

Composition: C (65.16%), H (7.42%), Cl (6.87%), N (8.14%), O (6.20%), S (6.21%)

Molar Mass: 516.14

Atom Count: 73

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	515.2373263
Formal Charge	0
FSP3	0.57
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	FQXCPZMUDHXOQY-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	147.63
Topological Polar Surface Area	61.44
Polarizability	55.88
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C28H38ClN3O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00