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Vitas-M small molecule compound

8-[(dibenzylamino)methyl]-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione

Catalog ID
STK653819
SMILES Cn1c2[nH]c(nc2c(=O)n(c1=O)C)CN(Cc1ccccc1)Cc1ccccc1

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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 C22H23N5O2 MW 389.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2/c1-25-20-19(21(28)26(2)22(25)29)23-18(24-20)15-27(13-16-9-5-3-6-10-16)14-17-11-7-4-8-12-17/h3-12H,13-15H2,1-2H3,(H,23,24)
InChIKey
RWMBUUVPVLVNSN-UHFFFAOYSA-N
Synonyms
578001-39-5
578001395
8((BIS(PHENYLMETHYL)AMINO)METHYL)13DIMETHYL7HPURINE26DIONE
8((BISBENZYLAMINO)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
8((dibenzylamino)methyl)13dimethyl1Hpurine26(3H7H)dione
8((dibenzylamino)methyl)13dimethyl39dihydro1Hpurine26dione
8((DIBENZYLAMINO)METHYL)13DIMETHYL7HPURINE26DIONE
8((DIBENZYLAMINO)METHYL)13DIMETHYL7HPURINE26QUINONE
Cn1c2(nH)c(nc2c(=O)n(c1=O)C)CN(Cc1ccccc1)Cc1ccccc1
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)CN(CC3=CC=CC=C3)CC4=CC=CC=C4
Cn1c2nc((nH)c2c(=O)n(c1=O)C)CN(Cc1ccccc1)Cc1ccccc1
InChI=1SC22H23N5O2c1252019(21(28)26(2)22(25)29)2318(2420)1527(131695361016)1417117481217h312H1315H212H3(H2324)
MFCD18166827
ZINC000095545647
ZINC95545647

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Available files

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