ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methyl-4-(thiophene-2-amido)phenyl]propanoate

ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methyl-4-(thiophene-2-amido)phenyl]propanoate

Formula: C17H16F3NO4S

SMILES: CCOC(=O)C(O)(C1=CC=C(NC(=O)C2=CC=CS2)C(C)=C1)C(F)(F)F

IUPAC: ethyl 3,3,3-trifluoro-2-hydroxy-2-[3-methyl-4-(thiophene-2-amido)phenyl]propanoate

InChI: InChI=1/C17H16F3NO4S/c1-3-25-15(23)16(24,17(18,19)20)11-6-7-12(10(2)9-11)21-14(22)13-5-4-8-26-13/h4-9,24H,3H2,1-2H3,(H,21,22)

Composition: C (52.71%), H (4.16%), F (14.71%), N (3.62%), O (16.52%), S (8.28%)

Molar Mass: 387.37

Atom Count: 42

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	387.075213662
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	ONQGDMYQQHDVFF-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.1
Topological Polar Surface Area	75.63
Polarizability	33.43
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H16F3NO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00