Vitas-M small molecule compound

3-[(2S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxobutan-2-yl]quinazolin-4(3H)-one

Catalog ID
STK717066
SMILES O=c1n(cnc2c1cccc2)[C@H](C(=O)N1CCC(CC1)Cc1ccccc1)C(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C25H29N3O2 MW 403.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O2/c1-18(2)23(28-17-26-22-11-7-6-10-21(22)24(28)29)25(30)27-14-12-20(13-15-27)16-19-8-4-3-5-9-19/h3-11,17-18,20,23H,12-16H2,1-2H3/t23-/m0/s1
InChIKey
CPAZLUOTNDSDCW-QHCPKHFHSA-N
Synonyms
1173685-17-0
(S)3(1(4benzylpiperidin1yl)3methyl1oxobutan2yl)quinazolin4(3H)one
1173685170
3((2S)1(4benzylpiperidin1yl)3methyl1oxobutan2yl)quinazolin4(3H)one
3((2S)1(4BENZYLPIPERIDIN1YL)3METHYL1OXOBUTAN2YL)QUINAZOLIN4ONE
CC(C)C(C(=O)N1CCC(CC1)CC2=CC=CC=C2)N3C=NC4=CC=CC=C4C3=O
InChI=1SC25H29N3O2c118(2)23(2817262211761021(22)24(28)29)25(30)27141220(131527)16198435919h31117182023H1216H212H3t23m0s1
MFCD06773724
O=c1n(cnc2c1cccc2)(C@H)(C(=O)N1CCC(CC1)Cc1ccccc1)C(C)C
ZINC000006658893
ZINC06658893
ZINC6658893

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.