ethyl 2-acetamido-2-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]amino}-3,3,3-trifluoropropanoate

ethyl 2-acetamido-2-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]amino}-3,3,3-trifluoropropanoate

Formula: C19H22F6N2O6

SMILES: CCOC(=O)C(NC(C)=O)(NC1=CC=C(C=C1C)C(O)(C(=O)OCC)C(F)(F)F)C(F)(F)F

IUPAC: ethyl 2-acetamido-2-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]amino}-3,3,3-trifluoropropanoate

InChI: InChI=1/C19H22F6N2O6/c1-5-32-14(29)16(31,18(20,21)22)12-7-8-13(10(3)9-12)27-17(19(23,24)25,26-11(4)28)15(30)33-6-2/h7-9,27,31H,5-6H2,1-4H3,(H,26,28)

Composition: C (46.73%), H (4.54%), F (23.34%), N (5.74%), O (19.66%)

Molar Mass: 488.383

Atom Count: 55

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	488.138205414
Formal Charge	0
FSP3	0.53
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	MMPFIHNQKYQBSV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.31
Topological Polar Surface Area	113.96
Polarizability	37.92
Ring Count	1
Rotatable Bond Count	12

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H22F6N2O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00