methyl 2-(4-methoxybenzamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

methyl 2-(4-methoxybenzamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

Formula: C17H17NO4S

SMILES: COC(=O)C1=C(NC(=O)C2=CC=C(OC)C=C2)SC2=C1CCC2

IUPAC: methyl 2-(4-methoxybenzamido)-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

InChI: InChI=1S/C17H17NO4S/c1-21-11-8-6-10(7-9-11)15(19)18-16-14(17(20)22-2)12-4-3-5-13(12)23-16/h6-9H,3-5H2,1-2H3,(H,18,19)

Composition: C (61.62%), H (5.17%), N (4.23%), O (19.31%), S (9.67%)

Molar Mass: 331.39

Atom Count: 40

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	331.087829205
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	NJZFWEJSJBFIPJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	89.16
Topological Polar Surface Area	64.63
Polarizability	33.23
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H17NO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00