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AJ-292/15007053 is available in 10 mg

Compound details
MDL #:		MFCD01613916
Formula:		C22 H18 N2 O3
Weight:		358.4
Chiral info:		Not available
Name:		2-(1,3-benzodioxol-5-yl)-3-benzyl-2,3-dihydro-4(1H)-quinazolinone
SMILES:		O=C4c5ccccc5(NC(c1ccc2OCOc2(c1))N4(Cc3ccccc3))
InChI^TM:		InChI=1S/C22H18N2O3/c25-22-17-8-4-5-9-18(17)23-21(24(22)13-15-6-2-1-3-7-15)16-10-11-19-20(12-16)27-14-26-19/h1-12,21,23H,13-14H2
InChIKey^TM:		VIAVCIGVAWVEIB-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		85 mg/Kg
Chronic LOAEL:		258 mg/Kg
AMES Mutagenicity:		1

Chemical properties calculations
LogP:	2.86	H-acceptors: 3
LogS:	-4.25	H-donors: 1
tPSA:	50.8 Å²	Rotatable bonds: 3

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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.