N-(2,4-dimethoxyphenyl)-2-[(E)-[(4-methoxyphenyl)methylidene]amino]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

N-(2,4-dimethoxyphenyl)-2-[(E)-[(4-methoxyphenyl)methylidene]amino]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

Formula: C26H28N2O4S

SMILES: COC1=CC=C(C=NC2=C(C(=O)NC3=CC=C(OC)C=C3OC)C3=C(CCCCC3)S2)C=C1

IUPAC: N-(2,4-dimethoxyphenyl)-2-[(E)-[(4-methoxyphenyl)methylidene]amino]-4H,5H,6H,7H,8H-cyclohepta[b]thiophene-3-carboxamide

InChI: InChI=1S/C26H28N2O4S/c1-30-18-11-9-17(10-12-18)16-27-26-24(20-7-5-4-6-8-23(20)33-26)25(29)28-21-14-13-19(31-2)15-22(21)32-3/h9-16H,4-8H2,1-3H3,(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	SVODPIKPNZQTST-JVWAILMASA-N
Lipinski's Rule of Five
Molar Refractivity	134.6
Topological Polar Surface Area	69.15
Polarizability	49.62
Ring Count	4
Rotatable Bond Count	7

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