6-tert-butyl-N-(2,4-dimethoxyphenyl)-2-[(E)-[(4-ethoxyphenyl)methylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

6-tert-butyl-N-(2,4-dimethoxyphenyl)-2-[(E)-[(4-ethoxyphenyl)methylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C30H36N2O4S

SMILES: CCOC1=CC=C(C=NC2=C(C(=O)NC3=CC=C(OC)C=C3OC)C3=C(CC(CC3)C(C)(C)C)S2)C=C1

IUPAC: 6-tert-butyl-N-(2,4-dimethoxyphenyl)-2-[(E)-[(4-ethoxyphenyl)methylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1/C30H36N2O4S/c1-7-36-21-11-8-19(9-12-21)18-31-29-27(23-14-10-20(30(2,3)4)16-26(23)37-29)28(33)32-24-15-13-22(34-5)17-25(24)35-6/h8-9,11-13,15,17-18,20H,7,10,14,16H2,1-6H3,(H,32,33)/b31-18+

Composition: C (69.20%), H (6.97%), N (5.38%), O (12.29%), S (6.16%)

Molar Mass: 520.69

Atom Count: 73

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	520.239578821
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	NQLHXULVEBMBPI-FDAWAROLNA-N
Lipinski's Rule of Five
Molar Refractivity	152.92
Topological Polar Surface Area	69.15
Polarizability	56.98
Ring Count	4
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C30H36N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00