N-(5-chloro-2-methoxyphenyl)-2-{2-[(furan-2-ylmethyl)amino]acetamido}-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

N-(5-chloro-2-methoxyphenyl)-2-{2-[(furan-2-ylmethyl)amino]acetamido}-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

Formula: C22H22ClN3O4S

SMILES: COC1=CC=C(Cl)C=C1NC(=O)C1=C(NC(=O)CNCC2=CC=CO2)SC2=C1CCC2

IUPAC: N-(5-chloro-2-methoxyphenyl)-2-(2-{[(furan-2-yl)methyl]amino}acetamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

InChI: InChI=1S/C22H22ClN3O4S/c1-29-17-8-7-13(23)10-16(17)25-21(28)20-15-5-2-6-18(15)31-22(20)26-19(27)12-24-11-14-4-3-9-30-14/h3-4,7-10,24H,2,5-6,11-12H2,1H3,(H,25,28)(H,26,27)

Composition: C (57.45%), H (4.82%), Cl (7.71%), N (9.14%), O (13.91%), S (6.97%)

Molar Mass: 459.95

Atom Count: 53

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	459.1019551
Formal Charge	0
FSP3	0.27
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	LJCSJPMAJDXOKF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	121.95
Topological Polar Surface Area	92.6
Polarizability	45.41
Ring Count	4
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H22ClN3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00