Vitas-M small molecule compound

7-(4-chlorobenzyl)-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK083552
SMILES Clc1ccc(cc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1

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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 C18H20ClN5O3 MW 389.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20ClN5O3/c1-21-15-14(16(25)22(2)18(21)26)24(11-12-3-5-13(19)6-4-12)17(20-15)23-7-9-27-10-8-23/h3-6H,7-11H2,1-2H3
InChIKey
CHJOXZNDECLJAV-UHFFFAOYSA-N
Synonyms
326919-18-0
326919180
7((4CHLOROPHENYL)METHYL)13DIMETHYL8MORPHOLIN4YLPURINE26DIONE
7(4CHLOROBENZYL)13DIMETHYL8(MORPHOLIN4YL)37DIHYDRO1HPURINE26DIONE
7(4CHLOROBENZYL)13DIMETHYL8MORPHOLIN4YL37DIHYDROPURINE26DIONE
7(4CHLOROBENZYL)13DIMETHYL8MORPHOLINO1HPURINE26(3H7H)DIONE
Clc1ccc(cc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCOCC3)CC4=CC=C(C=C4)Cl
InChI=1SC18H20ClN5O3c1211514(16(25)22(2)18(21)26)24(11123513(19)6412)17(2015)23792710823h36H711H212H3
MFCD00836305
STK083552
ZINC000000842264
ZINC00842264
ZINC842264

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.