Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-7-[4-(3-methylphenyl)piperazin-1-yl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL127271
SMILES Cc1cccc(c1)N1CCN(CC1)c1ncc2c(n1)[nH]c(=O)n(c2=O)c1ccc2c(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 C24H22N6O4 MW 458.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N6O4/c1-15-3-2-4-16(11-15)28-7-9-29(10-8-28)23-25-13-18-21(26-23)27-24(32)30(22(18)31)17-5-6-19-20(12-17)34-14-33-19/h2-6,11-13H,7-10,14H2,1H3,(H,25,26,27,32)InChIKey
JKXYEHQXJKUSDT-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)7(4(3methylphenyl)piperazin1yl)pyrimido(45d)pyrimidine24(1H3H)dione
6(13benzodioxol5yl)2(4(3methylphenyl)piperazin1yl)8Hpyrimido(45d)pyrimidine57dione
CC1=CC(=CC=C1)N2CCN(CC2)C3=NC=C4C(=N3)NC(=O)N(C4=O)C5=CC6=C(C=C5)OCO6
Cc1cccc(c1)N1CCN(CC1)c1ncc2c(n1)(nH)c(=O)n(c2=O)c1ccc2c(c1)OCO2
InChI=1SC24H22N6O4c11532416(1115)287929(10828)2325131821(2623)2724(32)30(22(18)31)17561920(1217)34143319h261113H71014H21H3(H25262732)
MFCD20740187
ZINC000067262776
ZINC67262776
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