(5Z)-5-({2-[2-(4-tert-butylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

(5Z)-5-({2-[2-(4-tert-butylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

Formula: C22H23NO3S2

SMILES: CC(C)(C)C1=CC=C(OCCOC2=CC=CC=C2C=C2/SC(=S)NC2=O)C=C1

IUPAC: (5Z)-5-({2-[2-(4-tert-butylphenoxy)ethoxy]phenyl}methylidene)-2-sulfanylidene-1,3-thiazolidin-4-one

InChI: InChI=1S/C22H23NO3S2/c1-22(2,3)16-8-10-17(11-9-16)25-12-13-26-18-7-5-4-6-15(18)14-19-20(24)23-21(27)28-19/h4-11,14H,12-13H2,1-3H3,(H,23,24,27)/b19-14-

Composition: C (63.90%), H (5.61%), N (3.39%), O (11.61%), S (15.50%)

Molar Mass: 413.55

Atom Count: 51

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	413.111935953
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	PBNPFYDPGIMEOB-RGEXLXHISA-N
Lipinski's Rule of Five
Molar Refractivity	119.89
Topological Polar Surface Area	47.56
Polarizability	46.4
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H23NO3S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00