ethyl 2-(furan-2-amido)-5-[(4-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

ethyl 2-(furan-2-amido)-5-[(4-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Formula: C21H20N2O6S

SMILES: CCOC(=O)C1=C(NC(=O)C2=CC=CO2)SC(C(=O)NC2=CC=C(OC)C=C2)=C1C

IUPAC: ethyl 2-(furan-2-amido)-5-[(4-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

InChI: InChI=1S/C21H20N2O6S/c1-4-28-21(26)16-12(2)17(19(25)22-13-7-9-14(27-3)10-8-13)30-20(16)23-18(24)15-6-5-11-29-15/h5-11H,4H2,1-3H3,(H,22,25)(H,23,24)

Composition: C (58.87%), H (4.71%), N (6.54%), O (22.40%), S (7.48%)

Molar Mass: 428.46

Atom Count: 50

Heavy Atom Count: 30

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	428.104207546
Formal Charge	0
FSP3	0.19
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	DWXOLZWKYXWBHZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	113.84
Topological Polar Surface Area	106.87
Polarizability	41.76
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H20N2O6S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00