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AJ-292/41601824 is available in 165 mg

Compound details
MDL #:		MFCD03719754
Formula:		C22 H20 N4 O S
Weight:		388.49
Chiral info:		Not available
Name:		4-benzyl-6,6-dimethyl-1-sulfanyl-6,7-dihydrobenzo[h][1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
SMILES:		CC5(C)(Cc1ccccc1C4=C5(C(=O)N(Cc2ccccc2)c3nnc(n34)S))
InChI^TM:		InChI=1S/C22H20N4OS/c1-22(2)12-15-10-6-7-11-16(15)18-17(22)19(27)25(13-14-8-4-3-5-9-14)20-23-24-21(28)26(18)20/h3-11H,12-13H2,1-2H3,(H,24,28)
InChIKey^TM:		ICMFBUKRYFPYQV-UHFFFAOYSA-N

Chemical properties calculations
LogP:	5.54	H-acceptors: 5
LogS:	-6.76
tPSA:	89.82 Å²	Rotatable bonds: 2

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