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

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

Formula: C27H30N2O5S

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

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

InChI: InChI=1S/C27H30N2O5S/c1-5-34-20-12-8-7-11-19(20)29-26(30)23-18-10-6-9-13-22(18)35-27(23)28-16-17-14-15-21(31-2)25(33-4)24(17)32-3/h7-8,11-12,14-16H,5-6,9-10,13H2,1-4H3,(H,29,30)/b28-16+

Composition: C (65.57%), H (6.11%), N (5.66%), O (16.17%), S (6.48%)

Molar Mass: 494.61

Atom Count: 65

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	494.187543248
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	CNBVQSVMEXFBCI-LQKURTRISA-N
Lipinski's Rule of Five
Molar Refractivity	141.21
Topological Polar Surface Area	78.38
Polarizability	52.16
Ring Count	4
Rotatable Bond Count	9

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C27H30N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00