Vitas-M small molecule compound
8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK597664
SMILES Clc1ccc(c(c1)N1CCN(CC1)Cc1[nH]c2c(n1)n(C)c(=O)nc2O)C
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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 C18H21ClN6O2 MW 388.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN6O2/c1-11-3-4-12(19)9-13(11)25-7-5-24(6-8-25)10-14-20-15-16(21-14)23(2)18(27)22-17(15)26/h3-4,9H,5-8,10H2,1-2H3,(H,20,21)(H,22,26,27)InChIKey
YZSUDYKEIXUORO-UHFFFAOYSA-NSynonyms
838899-81-38((4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)METHYL)3METHYL1HPURINE26(3H7H)DIONE
8((4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)METHYL)3METHYL7HPURINE26DIONE
8((4(5chloro2methylphenyl)piperazin1yl)methyl)6hydroxy3methyl37dihydro2Hpurin2one
8((4(5CHLORO2METHYLPHENYL)PIPERAZINYL)METHYL)3METHYL137TRIHYDROPURINE26DIONE
838899813
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC3=NC4=C(N3)C(=O)NC(=O)N4C
Clc1ccc(c(c1)N1CCN(CC1)Cc1(nH)c2c(n1)n(C)c(=O)nc2O)C
InChI=1SC18H21ClN6O2c1113412(19)913(11)257524(6825)1014201516(2114)23(2)18(27)2217(15)26h349H5810H212H3(H2021)(H222627)
MFCD07202816
ZINC000095481042
ZINC95481042
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