4-{[(2E,5E)-2-[(2,3-dichlorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene]methyl}benzoic acid

4-{[(2E,5E)-2-[(2,3-dichlorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene]methyl}benzoic acid

Formula: C17H10Cl2N2O3S

SMILES: OC(=O)C1=CC=C(C=C2SC(NC2=O)=NC2=CC=CC(Cl)=C2Cl)C=C1

IUPAC: 4-{[(2E,5E)-2-[(2,3-dichlorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene]methyl}benzoic acid

InChI: InChI=1S/C17H10Cl2N2O3S/c18-11-2-1-3-12(14(11)19)20-17-21-15(22)13(25-17)8-9-4-6-10(7-5-9)16(23)24/h1-8H,(H,23,24)(H,20,21,22)/b13-8+

Composition: C (51.92%), H (2.56%), Cl (18.03%), N (7.12%), O (12.21%), S (8.15%)

Molar Mass: 393.24

Atom Count: 35

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	391.9789188
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	TVNNMSRUDKWVKN-MDWZMJQESA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.83
Topological Polar Surface Area	78.76
Polarizability	37.52
Ring Count	3
Rotatable Bond Count	3

Suppliers

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Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H10Cl2N2O3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00