Vitas-M small molecule compound
7-(3-hydroxypropyl)-1,3-dimethyl-8-[(4-phenylpiperazin-1-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK582943
SMILES OCCCn1c(CN2CCN(CC2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)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 C21H28N6O3 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O3/c1-23-19-18(20(29)24(2)21(23)30)27(9-6-14-28)17(22-19)15-25-10-12-26(13-11-25)16-7-4-3-5-8-16/h3-5,7-8,28H,6,9-15H2,1-2H3InChIKey
YCQSABWXZGOWHQ-UHFFFAOYSA-NSynonyms
851941-47-47(3hydroxypropyl)13dimethyl8((4phenylpiperazin1yl)methyl)1Hpurine26(3H7H)dione
7(3hydroxypropyl)13dimethyl8((4phenylpiperazin1yl)methyl)37dihydro1Hpurine26dione
7(3HYDROXYPROPYL)13DIMETHYL8((4PHENYLPIPERAZIN1YL)METHYL)PURINE26DIONE
7(3HYDROXYPROPYL)13DIMETHYL8((4PHENYLPIPERAZINYL)METHYL)137TRIHYDROPURINE26DIONE
851941474
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=CC=C4)CCCO
InChI=1SC21H28N6O3c1231918(20(29)24(2)21(23)30)27(961428)17(2219)1525101226(131125)167435816h357828H6915H212H3
MFCD04466633
ZINC000012532238
ZINC12532238
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