3-{[(2E,5Z)-5-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid

3-{[(2E,5Z)-5-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid

Formula: C26H21FN2O5S

SMILES: COC1=CC(C=C2/SC(=NC3=CC=CC(=C3)C(O)=O)N(C)C2=O)=CC=C1OCC1=CC=CC=C1F

IUPAC: 3-{[(2E,5Z)-5-({4-[(2-fluorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoic acid

InChI: InChI=1S/C26H21FN2O5S/c1-29-24(30)23(35-26(29)28-19-8-5-7-17(14-19)25(31)32)13-16-10-11-21(22(12-16)33-2)34-15-18-6-3-4-9-20(18)27/h3-14H,15H2,1-2H3,(H,31,32)/b23-13-,28-26+

Composition: C (63.41%), H (4.30%), F (3.86%), N (5.69%), O (16.24%), S (6.51%)

Molar Mass: 492.52

Atom Count: 56

Heavy Atom Count: 35

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	492.115521121
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	CCPLKDYCDWFIPE-QDJMWYJCSA-N
Lipinski's Rule of Five
Molar Refractivity	134.87
Topological Polar Surface Area	88.43
Polarizability	49.81
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C26H21FN2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00