ethyl 2-[(5E)-5-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

ethyl 2-[(5E)-5-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Formula: C22H29NO5S

SMILES: CCOC(=O)CN1C(=O)SC(=CC2=CC(=C(O)C(=C2)C(C)(C)C)C(C)(C)C)C1=O

IUPAC: ethyl 2-[(5E)-5-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

InChI: InChI=1S/C22H29NO5S/c1-8-28-17(24)12-23-19(26)16(29-20(23)27)11-13-9-14(21(2,3)4)18(25)15(10-13)22(5,6)7/h9-11,25H,8,12H2,1-7H3/b16-11+

Composition: C (62.98%), H (6.97%), N (3.34%), O (19.07%), S (7.64%)

Molar Mass: 419.54

Atom Count: 58

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	419.176644212
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	YWLICUZZTRRSIJ-LFIBNONCSA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.03
Topological Polar Surface Area	83.91
Polarizability	44.44
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H29NO5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00