Vitas-M small molecule compound
3-(1,3-benzodioxol-5-yl)-7-(cycloheptylamino)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Catalog ID
STL126581
SMILES O=c1[nH]c2nc(ncc2c(=O)n1c1ccc2c(c1)OCO2)NC1CCCCCC1
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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 C20H21N5O4 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4/c26-18-14-10-21-19(22-12-5-3-1-2-4-6-12)23-17(14)24-20(27)25(18)13-7-8-15-16(9-13)29-11-28-15/h7-10,12H,1-6,11H2,(H2,21,22,23,24,27)InChIKey
ZMZFMRLEXYGXHA-UHFFFAOYSA-NSynonyms
3(13benzodioxol5yl)7(cycloheptylamino)pyrimido(45d)pyrimidine24(1H3H)dione
6(13benzodioxol5yl)2(cycloheptylamino)8Hpyrimido(45d)pyrimidine57dione
C1CCCC(CC1)NC2=NC=C3C(=N2)NC(=O)N(C3=O)C4=CC5=C(C=C4)OCO5
InChI=1SC20H21N5O4c261814102119(221253124612)2317(14)2420(27)25(18)13781516(913)29112815h71012H1611H2(H22122232427)
MFCD20739210
O=c1(nH)c2nc(ncc2c(=O)n1c1ccc2c(c1)OCO2)NC1CCCCCC1
ZINC000067261533
ZINC67261533
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