Vitas-M small molecule compound
benzyl [8-(3-hydroxypropyl)-1,7-dimethyl-2,4-dioxo-1,2,4,8-tetrahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Catalog ID
STK645648
SMILES OCCCn1c(C)cn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OCc1ccccc1
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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 C21H23N5O5 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O5/c1-14-11-25-17-18(22-20(25)24(14)9-6-10-27)23(2)21(30)26(19(17)29)12-16(28)31-13-15-7-4-3-5-8-15/h3-5,7-8,11,27H,6,9-10,12-13H2,1-2H3InChIKey
CXWVWPHYFNHXRF-UHFFFAOYSA-NSynonyms
1010933-79-51010933795
benzyl(8(3hydroxypropyl)17dimethyl24dioxo1248tetrahydro3Himidazo(21f)purin3yl)acetate
benzyl2(6(3hydroxypropyl)47dimethyl13dioxopurino(78a)imidazol2yl)acetate
benzyl2(8(3hydroxypropyl)17dimethyl24dioxo1Himidazo(21f)purin3(2H4H8H)yl)acetate
CC1=CN2C3=C(N=C2N1CCCO)N(C(=O)N(C3=O)CC(=O)OCC4=CC=CC=C4)C
InChI=1SC21H23N5O5c11411251718(2220(25)24(14)961027)23(2)21(30)26(19(17)29)1216(28)3113157435815h35781127H69101213H212H3
MFCD12200851
PHENYLMETHYL2(8(3HYDROXYPROPYL)17DIMETHYL24DIOXO135TRIHYDRO4IMIDAZOLINO(12H)PURIN3YL)ACETATE
ZINC000012323623
ZINC12323623
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