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

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

Formula: C25H26N2O3S

SMILES: COC1=CC=C(OC)C(C=NC2=C(C(=O)NC3=CC=CC=C3)C3=C(CC(C)CC3)S2)=C1

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

InChI: InChI=1/C25H26N2O3S/c1-16-9-11-20-22(13-16)31-25(23(20)24(28)27-18-7-5-4-6-8-18)26-15-17-14-19(29-2)10-12-21(17)30-3/h4-8,10,12,14-16H,9,11,13H2,1-3H3,(H,27,28)/b26-15+

Composition: C (69.10%), H (6.03%), N (6.45%), O (11.05%), S (7.38%)

Molar Mass: 434.55

Atom Count: 57

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	1
Exact Mass	434.166413879
Formal Charge	0
FSP3	0.28
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZUJNXOYFMXQPHZ-CVKSISIWNA-N
Lipinski's Rule of Five
Molar Refractivity	128.08
Topological Polar Surface Area	59.92
Polarizability	47.1
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H26N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00