3-[(5Z)-5-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

3-[(5Z)-5-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

Formula: C19H23NO5S2

SMILES: CCCCCOC1=CC=C(C=C2/SC(=S)N(CCC(O)=O)C2=O)C=C1OC

IUPAC: 3-[(5Z)-5-{[3-methoxy-4-(pentyloxy)phenyl]methylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

InChI: InChI=1S/C19H23NO5S2/c1-3-4-5-10-25-14-7-6-13(11-15(14)24-2)12-16-18(23)20(19(26)27-16)9-8-17(21)22/h6-7,11-12H,3-5,8-10H2,1-2H3,(H,21,22)/b16-12-

Composition: C (55.73%), H (5.66%), N (3.42%), O (19.53%), S (15.66%)

Molar Mass: 409.52

Atom Count: 50

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	409.101765193
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	XJFZYIFEKWGTPS-VBKFSLOCSA-N
Lipinski's Rule of Five	1
Molar Refractivity	111.29
Topological Polar Surface Area	76.07
Polarizability	42.93
Ring Count	2
Rotatable Bond Count	10

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H23NO5S2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00