(2E,5Z)-3-benzyl-2-(benzylimino)-5-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

(2E,5Z)-3-benzyl-2-(benzylimino)-5-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

Formula: C25H21N3O4S

SMILES: COC1=CC=C(C=C2/SC(=NCC3=CC=CC=C3)N(CC3=CC=CC=C3)C2=O)C=C1[N+]([O-])=O

IUPAC: (2E,5Z)-3-benzyl-2-(benzylimino)-5-[(4-methoxy-3-nitrophenyl)methylidene]-1,3-thiazolidin-4-one

InChI: InChI=1S/C25H21N3O4S/c1-32-22-13-12-20(14-21(22)28(30)31)15-23-24(29)27(17-19-10-6-3-7-11-19)25(33-23)26-16-18-8-4-2-5-9-18/h2-15H,16-17H2,1H3/b23-15-,26-25+

Composition: C (65.35%), H (4.61%), N (9.14%), O (13.93%), S (6.98%)

Molar Mass: 459.52

Atom Count: 54

Heavy Atom Count: 33

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	459.125277342
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	CBBCNDPZNFMWTD-GTZNUUOLSA-N
Lipinski's Rule of Five
Molar Refractivity	130.08
Topological Polar Surface Area	85.04
Polarizability	49
Ring Count	4
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H21N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00