Vitas-M small molecule compound
2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-6-methyl-5-propylpyrimidin-4(3H)-one
Catalog ID
STK273296
SMILES CCCc1c(C)nc([nH]c1=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C20H26N4O3 MW 370.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O3/c1-3-4-16-14(2)21-20(22-19(16)25)24-9-7-23(8-10-24)12-15-5-6-17-18(11-15)27-13-26-17/h5-6,11H,3-4,7-10,12-13H2,1-2H3,(H,21,22,25)InChIKey
XJQGOLWDKLCLMT-UHFFFAOYSA-NSynonyms
2(4(13benzodioxol5ylmethyl)piperazin1yl)6methyl5propyl1Hpyrimidin4one
2(4(13benzodioxol5ylmethyl)piperazin1yl)6methyl5propylpyrimidin4(3H)one
2(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)6METHYL5PROPYL3HYDROPYRIMIDIN4ONE
CCCC1=C(NC(=NC1=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C
CCCc1c(C)nc((nH)c1=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
InChI=1SC20H26N4O3c1341614(2)2120(2219(16)25)249723(81024)1215561718(1115)27132617h5611H347101213H212H3(H212225)
MFCD08709632
ZINC000009614660
ZINC9614660
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