Vitas-M small molecule compound
8-(azepan-1-yl)-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL004861
SMILES OC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCCC1)COc1ccccc1
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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 C22H29N5O4 MW 427.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O4/c1-24-19-18(20(29)25(2)22(24)30)27(21(23-19)26-12-8-3-4-9-13-26)14-16(28)15-31-17-10-6-5-7-11-17/h5-7,10-11,16,28H,3-4,8-9,12-15H2,1-2H3InChIKey
YNARQTRGBVMTCM-UHFFFAOYSA-NSynonyms
799258-01-8799258018
8(AZEPAN1YL)7(2HYDROXY3PHENOXYPROPYL)13DIMETHYL1HPURINE26(3H7H)DIONE
8(azepan1yl)7(2hydroxy3phenoxypropyl)13dimethyl37dihydro1Hpurine26dione
8(AZEPAN1YL)7(2HYDROXY3PHENOXYPROPYL)13DIMETHYLPURINE26DIONE
8AZEPAN1YL7(2HYDROXY3PHENOXYPROPYL)13DIMETHYL37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCCC3)CC(COC4=CC=CC=C4)O
InChI=1SC22H29N5O4c1241918(20(29)25(2)22(24)30)27(21(2319)261283491326)1416(28)153117106571117h5710111628H34891215H212H3
MFCD04190326
ZINC000000801713
ZINC000000801714
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