4-(4-{[(5Z)-3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxymethyl)benzoic acid

4-(4-{[(5Z)-3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxymethyl)benzoic acid

Formula: C20H17NO5S

SMILES: CCN1C(=O)SC(=C/C2=CC=C(OCC3=CC=C(C=C3)C(O)=O)C=C2)C1=O

IUPAC: 4-[(4-{[(5Z)-3-ethyl-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}phenoxy)methyl]benzoic acid

InChI: InChI=1S/C20H17NO5S/c1-2-21-18(22)17(27-20(21)25)11-13-5-9-16(10-6-13)26-12-14-3-7-15(8-4-14)19(23)24/h3-11H,2,12H2,1H3,(H,23,24)/b17-11-

Composition: C (62.65%), H (4.47%), N (3.65%), O (20.86%), S (8.36%)

Molar Mass: 383.42

Atom Count: 44

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	383.082743825
Formal Charge	0
FSP3	0.15
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	UXEFEIXABSBYMK-BOPFTXTBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	104.2
Topological Polar Surface Area	83.91
Polarizability	39.25
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H17NO5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00