2-(5-chlorothiophen-2-yl)-N-{3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}quinoline-4-carboxamide

2-(5-chlorothiophen-2-yl)-N-{3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}quinoline-4-carboxamide

Formula: C24H18ClN3OS2

SMILES: ClC1=CC=C(S1)C1=NC2=CC=CC=C2C(=C1)C(=O)NC1=C(C#N)C2=C(CCCCC2)S1

IUPAC: 2-(5-chlorothiophen-2-yl)-N-{3-cyano-4H,5H,6H,7H,8H-cyclohepta[b]thiophen-2-yl}quinoline-4-carboxamide

InChI: InChI=1S/C24H18ClN3OS2/c25-22-11-10-21(30-22)19-12-16(14-6-4-5-8-18(14)27-19)23(29)28-24-17(13-26)15-7-2-1-3-9-20(15)31-24/h4-6,8,10-12H,1-3,7,9H2,(H,28,29)

Composition: C (62.13%), H (3.91%), Cl (7.64%), N (9.06%), O (3.45%), S (13.82%)

Molar Mass: 464

Atom Count: 49

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	463.0579823
Formal Charge	0
FSP3	0.21
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BNOKKUQKRTYGRA-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	125.14
Topological Polar Surface Area	65.78
Polarizability	49.9
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C24H18ClN3OS2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00