ethyl 2-[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-amido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

ethyl 2-[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-amido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

Formula: C21H19ClN2O4S

SMILES: CCOC(=O)C1=C(NC(=O)C2=C(C)ON=C2C2=CC=CC=C2Cl)SC2=C1CCC2

IUPAC: ethyl 2-[3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-amido]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

InChI: InChI=1S/C21H19ClN2O4S/c1-3-27-21(26)17-13-8-6-10-15(13)29-20(17)23-19(25)16-11(2)28-24-18(16)12-7-4-5-9-14(12)22/h4-5,7,9H,3,6,8,10H2,1-2H3,(H,23,25)

Composition: C (58.54%), H (4.44%), Cl (8.23%), N (6.50%), O (14.85%), S (7.44%)

Molar Mass: 430.9

Atom Count: 48

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	430.075406
Formal Charge	0
FSP3	0.29
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WZQWSCBGKXQQQH-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	113.61
Topological Polar Surface Area	81.43
Polarizability	43.15
Ring Count	4
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H19ClN2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00