(5Z)-3-(prop-2-yn-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

(5Z)-3-(prop-2-yn-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

Formula: C16H15NO5S

SMILES: COC1=CC(C=C2/SC(=O)N(CC#C)C2=O)=CC(OC)=C1OC

IUPAC: (5Z)-3-(prop-2-yn-1-yl)-5-[(3,4,5-trimethoxyphenyl)methylidene]-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C16H15NO5S/c1-5-6-17-15(18)13(23-16(17)19)9-10-7-11(20-2)14(22-4)12(8-10)21-3/h1,7-9H,6H2,2-4H3/b13-9-

Composition: C (57.65%), H (4.54%), N (4.20%), O (24.00%), S (9.62%)

Molar Mass: 333.36

Atom Count: 38

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	333.067093761
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	UUAQICBBSJUKLL-LCYFTJDESA-N
Lipinski's Rule of Five	1
Molar Refractivity	88.09
Topological Polar Surface Area	65.07
Polarizability	33.15
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H15NO5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00