Vitas-M small molecule compound
8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK059534
SMILES COc1ccc(cc1)OCC(Cn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C)O
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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 C23H23ClN6O5 MW 498.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClN6O5/c1-29-20-19(21(32)27-23(29)33)30(12-16(31)13-35-18-9-7-17(34-2)8-10-18)22(26-20)28-25-11-14-3-5-15(24)6-4-14/h3-11,16,31H,12-13H2,1-2H3,(H,26,28)(H,27,32,33)/b25-11+InChIKey
OVXBEOMLPGIAEB-OPEKNORGSA-NSynonyms
303970-81-2(E)8(2(4chlorobenzylidene)hydrazinyl)7(2hydroxy3(4methoxyphenoxy)propyl)3methyl1Hpurine26(3H7H)dione
303970812
8((2E)2((4chlorophenyl)methylidene)hydrazinyl)7(2hydroxy3(4methoxyphenoxy)propyl)3methylpurine26dione
8((2E)2(4CHLOROBENZYLIDENE)HYDRAZINYL)7(2HYDROXY3(4METHOXYPHENOXY)PROPYL)3METHYL37DIHYDRO1HPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=C(C=C3)Cl)CC(COC4=CC=C(C=C4)OC)O
COc1ccc(cc1)OCC(Cn1c(NN=Cc2ccc(cc2)Cl)nc2c1c(=O)(nH)c(=O)n2C)O
InChI=1SC23H23ClN6O5c1292019(21(32)2723(29)33)30(1216(31)1335189717(342)81018)22(2620)282511143515(24)6414h3111631H1213H212H3(H2628)(H273233)b2511+
MFCD01553916
STK059534
ZINC000008809492
ZINC000008809493
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