Vitas-M small molecule compound
3-{(2S)-1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-methyl-1-oxobutan-2-yl}quinazolin-4(3H)-one
Catalog ID
STK576697
SMILES CC([C@H](n1cnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)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 C25H28N4O4 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4/c1-17(2)23(29-15-26-20-6-4-3-5-19(20)24(29)30)25(31)28-11-9-27(10-12-28)14-18-7-8-21-22(13-18)33-16-32-21/h3-8,13,15,17,23H,9-12,14,16H2,1-2H3/t23-/m0/s1InChIKey
BYTGMUNLLUPDQO-QHCPKHFHSA-NSynonyms
1173677-52-5(S)3(1(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)3methyl1oxobutan2yl)quinazolin4(3H)one
1173677525
3((2S)1(4(13benzodioxol5ylmethyl)piperazin1yl)3methyl1oxobutan2yl)quinazolin4(3H)one
3((2S)1(4(13benzodioxol5ylmethyl)piperazin1yl)3methyl1oxobutan2yl)quinazolin4one
CC((C@H)(n1cnc2c(c1=O)cccc2)C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C
CC(C)C(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)N4C=NC5=CC=CC=C5C4=O
InChI=1SC25H28N4O4c117(2)23(29152620643519(20)24(29)30)25(31)2811927(101228)1418782122(1318)33163221h3813151723H9121416H212H3t23m0s1
MFCD06775814
ZINC000013555703
ZINC13555703
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