Vitas-M small molecule compound
7-benzyl-6-hydroxy-3-methyl-8-[(1-phenylethyl)amino]-3,7-dihydro-2H-purin-2-one
Catalog ID
STK565996
SMILES CC(c1ccccc1)Nc1nc2c(n1Cc1ccccc1)c(O)nc(=O)n2C
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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 C21H21N5O2 MW 375.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5O2/c1-14(16-11-7-4-8-12-16)22-20-23-18-17(19(27)24-21(28)25(18)2)26(20)13-15-9-5-3-6-10-15/h3-12,14H,13H2,1-2H3,(H,22,23)(H,24,27,28)InChIKey
JTKSXPSGYYQWQT-UHFFFAOYSA-NSynonyms
578757-65-03METHYL8((PHENYLETHYL)AMINO)7BENZYL137TRIHYDROPURINE26DIONE
578757650
7BENZYL3METHYL8((1PHENYLETHYL)AMINO)1HPURINE26(3H7H)DIONE
7BENZYL3METHYL8(1PHENYLETHYLAMINO)PURINE26DIONE
7benzyl6hydroxy3methyl8((1phenylethyl)amino)37dihydro2Hpurin2one
CC(C1=CC=CC=C1)NC2=NC3=C(N2CC4=CC=CC=C4)C(=O)NC(=O)N3C
InChI=1SC21H21N5O2c114(16117481216)2220231817(19(27)2421(28)25(18)2)26(20)131595361015h31214H13H212H3(H2223)(H242728)
MFCD04077362
ZINC000001265653
ZINC000001265654
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