3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-nitrophenyl)-1,3-thiazolidin-4-one

3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-nitrophenyl)-1,3-thiazolidin-4-one

Formula: C19H20N2O5S

SMILES: COC1=CC=C(CCN2C(SCC2=O)C2=CC=CC(=C2)[N+]([O-])=O)C=C1OC

IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethyl]-2-(3-nitrophenyl)-1,3-thiazolidin-4-one

InChI: InChI=1/C19H20N2O5S/c1-25-16-7-6-13(10-17(16)26-2)8-9-20-18(22)12-27-19(20)14-4-3-5-15(11-14)21(23)24/h3-7,10-11,19H,8-9,12H2,1-2H3

Composition: C (58.75%), H (5.19%), N (7.21%), O (20.59%), S (8.25%)

Molar Mass: 388.44

Atom Count: 47

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	388.109292926
Formal Charge	0
FSP3	0.32
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	UMVVDGNEOFPERV-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	102.98
Topological Polar Surface Area	81.91
Polarizability	39.61
Ring Count	3
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C19H20N2O5S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00