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AN-989/40746385 is available in 171 mg

Compound details
MDL #:		MFCD03236257
Formula:		C19 H17 Br N2 O3 S
Weight:		433.32
Chiral info:		Not available
Name:		2-[(4-bromophenyl)imino]-5-(2,4-dimethoxybenzylidene)-3-methyl-1,3-thiazolidin-4-one
SMILES:		COc3ccc(C=C2C(=O)N(C)C(=Nc1ccc(cc1)Br)S2)c(c3)OC
InChI^TM:		InChI=1S/C19H17BrN2O3S/c1-22-18(23)17(10-12-4-9-15(24-2)11-16(12)25-3)26-19(22)21-14-7-5-13(20)6-8-14/h4-11H,1-3H3
InChIKey^TM:		ZVOIDVANGPUXAT-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		8350 mg/Kg
Chronic LOAEL:		220 mg/Kg
AMES Mutagenicity:		1

Chemical properties calculations
LogP:	3.72	H-acceptors: 3
LogS:	-5.54
tPSA:	76.43 Å²	Rotatable bonds: 4

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.