4-({5-[(3-methylphenyl)amino]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzoic acid

4-({5-[(3-methylphenyl)amino]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzoic acid

Formula: C18H16N2O4S

SMILES: CC1=CC=CC(NC2SC(=O)N(CC3=CC=C(C=C3)C(O)=O)C2=O)=C1

IUPAC: 4-({5-[(3-methylphenyl)amino]-2,4-dioxo-1,3-thiazolidin-3-yl}methyl)benzoic acid

InChI: InChI=1/C18H16N2O4S/c1-11-3-2-4-14(9-11)19-15-16(21)20(18(24)25-15)10-12-5-7-13(8-6-12)17(22)23/h2-9,15,19H,10H2,1H3,(H,22,23)

Composition: C (60.66%), H (4.53%), N (7.86%), O (17.96%), S (9.00%)

Molar Mass: 356.4

Atom Count: 41

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	356.083078177
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	MFIXAGLTBWJEKI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.54
Topological Polar Surface Area	86.71
Polarizability	36.21
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H16N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00