(5E)-5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

(5E)-5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

Formula: C20H14BrNO3S

SMILES: BrC1=CC(C=C2SC(=O)N(CC#C)C2=O)=CC=C1OCC1=CC=CC=C1

IUPAC: (5E)-5-{[4-(benzyloxy)-3-bromophenyl]methylidene}-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C20H14BrNO3S/c1-2-10-22-19(23)18(26-20(22)24)12-15-8-9-17(16(21)11-15)25-13-14-6-4-3-5-7-14/h1,3-9,11-12H,10,13H2/b18-12+

Composition: C (56.09%), H (3.29%), Br (18.66%), N (3.27%), O (11.21%), S (7.49%)

Molar Mass: 428.3

Atom Count: 40

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	426.987777
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	ABCPOTKOWAIJJU-LDADJPATSA-N
Lipinski's Rule of Five	1
Molar Refractivity	107.4
Topological Polar Surface Area	46.61
Polarizability	40.4
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H14BrNO3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00