N-(2,4-dimethoxyphenyl)-2-(thiophene-2-amido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

N-(2,4-dimethoxyphenyl)-2-(thiophene-2-amido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Formula: C22H22N2O4S2

SMILES: COC1=CC=C(NC(=O)C2=C(NC(=O)C3=CC=CS3)SC3=C2CCCC3)C(OC)=C1

IUPAC: N-(2,4-dimethoxyphenyl)-2-(thiophene-2-amido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

InChI: InChI=1S/C22H22N2O4S2/c1-27-13-9-10-15(16(12-13)28-2)23-21(26)19-14-6-3-4-7-17(14)30-22(19)24-20(25)18-8-5-11-29-18/h5,8-12H,3-4,6-7H2,1-2H3,(H,23,26)(H,24,25)

Composition: C (59.71%), H (5.01%), N (6.33%), O (14.46%), S (14.49%)

Molar Mass: 442.55

Atom Count: 52

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	442.102099544
Formal Charge	0
FSP3	0.27
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	VQKCQFFZJFHNOY-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	120.63
Topological Polar Surface Area	76.66
Polarizability	44.46
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H22N2O4S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00