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

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

Formula: C26H28N2O4S

SMILES: CCOC1=CC=CC=C1NC(=O)C1=C(SC2=C1CCCC2)N=CC1=CC=CC(OC)=C1OC

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

InChI: InChI=1S/C26H28N2O4S/c1-4-32-20-13-7-6-12-19(20)28-25(29)23-18-11-5-8-15-22(18)33-26(23)27-16-17-10-9-14-21(30-2)24(17)31-3/h6-7,9-10,12-14,16H,4-5,8,11,15H2,1-3H3,(H,28,29)/b27-16+

Composition: C (67.22%), H (6.08%), N (6.03%), O (13.78%), S (6.90%)

Molar Mass: 464.58

Atom Count: 61

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	464.176978564
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XWMROHBOLLTUNI-JVWAILMASA-N
Lipinski's Rule of Five
Molar Refractivity	134.75
Topological Polar Surface Area	69.15
Polarizability	49.63
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H28N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00