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AK-968/15364150 is available in 61 mg

Compound details
MDL #:		MFCD02175315
Formula:		C23 H17 N5 O2 S2
Weight:		459.55
Chiral info:		Not available
Name:		2-[(5-cyano-6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)acetamide
SMILES:		Cc3c(nc(NC(=O)CSC=1NC(=O)C(C#N)=C(N=1)c2ccccc2)s3)c4ccccc4
InChI^TM:		InChI=1S/C23H17N5O2S2/c1-14-19(15-8-4-2-5-9-15)26-23(32-14)25-18(29)13-31-22-27-20(16-10-6-3-7-11-16)17(12-24)21(30)28-22/h2-11H,13H2,1H3,(H,25,26,29)(H,27,28,30)
InChIKey^TM:		BBBRYZXRJZCNFL-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		727 mg/Kg
Chronic LOAEL:		49 mg/Kg
Developmental Toxicity Potential:		1

Chemical properties calculations
LogP:	4.8	H-acceptors: 7
LogS:	-6.91	H-donors: 2
tPSA:	160.78 Å²	Rotatable bonds: 7

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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.