N-{3-[(2-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

N-{3-[(2-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

Formula: C22H22N2O3S

SMILES: CCC1=CC=CC=C1NC(=O)C1=C(NC(=O)C2=CC=CO2)SC2=C1CCCC2

IUPAC: N-{3-[(2-ethylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}furan-2-carboxamide

InChI: InChI=1S/C22H22N2O3S/c1-2-14-8-3-5-10-16(14)23-21(26)19-15-9-4-6-12-18(15)28-22(19)24-20(25)17-11-7-13-27-17/h3,5,7-8,10-11,13H,2,4,6,9,12H2,1H3,(H,23,26)(H,24,25)

Composition: C (66.98%), H (5.62%), N (7.10%), O (12.17%), S (8.13%)

Molar Mass: 394.49

Atom Count: 50

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	394.13511375
Formal Charge	0
FSP3	0.27
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	NOSJDKKGBOGTBJ-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	112.84
Topological Polar Surface Area	71.34
Polarizability	41.19
Ring Count	4
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H22N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00