(5E)-5-[(3-bromo-5-chloro-2-hydroxyphenyl)methylidene]-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

(5E)-5-[(3-bromo-5-chloro-2-hydroxyphenyl)methylidene]-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

Formula: C13H7BrClNO3S

SMILES: OC1=C(Br)C=C(Cl)C=C1C=C1SC(=O)N(CC#C)C1=O

IUPAC: (5E)-5-[(3-bromo-5-chloro-2-hydroxyphenyl)methylidene]-3-(prop-2-yn-1-yl)-1,3-thiazolidine-2,4-dione

InChI: InChI=1S/C13H7BrClNO3S/c1-2-3-16-12(18)10(20-13(16)19)5-7-4-8(15)6-9(14)11(7)17/h1,4-6,17H,3H2/b10-5+

Composition: C (41.90%), H (1.89%), Br (21.44%), Cl (9.51%), N (3.76%), O (12.88%), S (8.60%)

Molar Mass: 372.62

Atom Count: 27

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	370.901855
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	LXXKMGFQJOTDEL-BJMVGYQFSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.11
Topological Polar Surface Area	57.61
Polarizability	31.01
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C13H7BrClNO3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00