Vitas-M small molecule compound

8-(cyclopentylamino)-7-(2,6-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL340165
SMILES Clc1cccc(c1Cn1c(NC2CCCC2)nc2c1c(=O)n(C)c(=O)n2C)Cl

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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 C19H21Cl2N5O2 MW 422.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21Cl2N5O2/c1-24-16-15(17(27)25(2)19(24)28)26(10-12-13(20)8-5-9-14(12)21)18(23-16)22-11-6-3-4-7-11/h5,8-9,11H,3-4,6-7,10H2,1-2H3,(H,22,23)
InChIKey
IXUJYBMNTBZGKS-UHFFFAOYSA-N
Synonyms
573669-16-6
573669166
8(CYCLOPENTYLAMINO)7((26DICHLOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(cyclopentylamino)7(26dichlorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(cyclopentylamino)7(26dichlorobenzyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NC3CCCC3)CC4=C(C=CC=C4Cl)Cl
InChI=1SC19H21Cl2N5O2c1241615(17(27)25(2)19(24)28)26(101213(20)85914(12)21)18(2316)2211634711h58911H346710H212H3(H2223)
MFCD04017337
ZINC000009459746
ZINC09459746
ZINC9459746

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Available files

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