Vitas-M small molecule compound
7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840381
SMILES OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCC1)COc1ccc(cc1)Cl
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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 C19H22ClN5O4 MW 419.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22ClN5O4/c1-23-16-15(17(27)22-19(23)28)25(18(21-16)24-8-2-3-9-24)10-13(26)11-29-14-6-4-12(20)5-7-14/h4-7,13,26H,2-3,8-11H2,1H3,(H,22,27,28)InChIKey
SAAQTJDKFDGREJ-UHFFFAOYSA-NSynonyms
333752-15-1333752151
7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8(PYRROLIDIN1YL)1HPURINE26(3H7H)DIONE
7(3(4chlorophenoxy)2hydroxypropyl)3methyl8(pyrrolidin1yl)37dihydro1Hpurine26dione
7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8PYRROLIDIN1YLPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCCC3)CC(COC4=CC=C(C=C4)Cl)O
InChI=1SC19H22ClN5O4c1231615(17(27)2219(23)28)25(18(2116)24823924)1013(26)1129146412(20)5714h471326H23811H21H3(H222728)
MFCD02579082
OC(Cn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCCC1)COc1ccc(cc1)Cl
ZINC000000629377
ZINC000000629379
ZINC00629377
ZINC00629379
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