ethyl 4-methyl-5-{[3-(trifluoromethyl)phenyl]carbamoyl}-2-(3,4,5-trimethoxybenzamido)thiophene-3-carboxylate

ethyl 4-methyl-5-{[3-(trifluoromethyl)phenyl]carbamoyl}-2-(3,4,5-trimethoxybenzamido)thiophene-3-carboxylate

Formula: C26H25F3N2O7S

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

IUPAC: ethyl 4-methyl-5-{[3-(trifluoromethyl)phenyl]carbamoyl}-2-(3,4,5-trimethoxybenzamido)thiophene-3-carboxylate

InChI: InChI=1S/C26H25F3N2O7S/c1-6-38-25(34)19-13(2)21(23(33)30-16-9-7-8-15(12-16)26(27,28)29)39-24(19)31-22(32)14-10-17(35-3)20(37-5)18(11-14)36-4/h7-12H,6H2,1-5H3,(H,30,33)(H,31,32)

Composition: C (55.12%), H (4.45%), F (10.06%), N (4.94%), O (19.77%), S (5.66%)

Molar Mass: 566.55

Atom Count: 64

Heavy Atom Count: 39

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	566.133456816
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	IYGZKOQFFQAJMB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	140.35
Topological Polar Surface Area	112.19
Polarizability	51.11
Ring Count	3
Rotatable Bond Count	11

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H25F3N2O7S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00