N-(3-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

N-(3-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

Formula: C16H12ClF3N2O2S

SMILES: FC(F)(F)C(=O)NC1=C(C(=O)NC2=CC(Cl)=CC=C2)C2=C(CCC2)S1

IUPAC: N-(3-chlorophenyl)-2-(2,2,2-trifluoroacetamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxamide

InChI: InChI=1S/C16H12ClF3N2O2S/c17-8-3-1-4-9(7-8)21-13(23)12-10-5-2-6-11(10)25-14(12)22-15(24)16(18,19)20/h1,3-4,7H,2,5-6H2,(H,21,23)(H,22,24)

Composition: C (49.43%), H (3.11%), Cl (9.12%), F (14.66%), N (7.21%), O (8.23%), S (8.25%)

Molar Mass: 388.79

Atom Count: 37

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	388.026011
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	YYFPJPUWXBBZHB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	91.35
Topological Polar Surface Area	58.2
Polarizability	32.52
Ring Count	3
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H12ClF3N2O2S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00