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AN-919/41375167 is available in 11 mg

Compound details
Formula:		C24 H28 N2 O2 S
Weight:		408.56
Chiral info:		Not available
Name:		2-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-6-tert-pentyl-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
SMILES:		CCC(C)(C)C1CCc2nc(c(C#N)cc2(C1))SCC(=O)c3ccc(cc3)OC
InChI^TM:		InChI=1S/C24H28N2O2S/c1-5-24(2,3)19-8-11-21-17(13-19)12-18(14-25)23(26-21)29-15-22(27)16-6-9-20(28-4)10-7-16/h6-7,9-10,12,19H,5,8,11,13,15H2,1-4H3
InChIKey^TM:		QMIZRWGSMALYIG-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		4910 mg/Kg
Chronic LOAEL:		72 mg/Kg

Chemical properties calculations
LogP:	6.56	H-acceptors: 3
LogS:	-8.05
tPSA:	88.28 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.