Vitas-M small molecule compound

5-(3-bromophenyl)-6-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione

Catalog ID
STK855989
SMILES OCC(n1cc2c(c1c1cccc(c1)Br)c(=O)n(c(=O)n2C)C)(CO)CO

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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 C18H20BrN3O5 MW 438.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20BrN3O5/c1-20-13-7-22(18(8-23,9-24)10-25)15(11-4-3-5-12(19)6-11)14(13)16(26)21(2)17(20)27/h3-7,23-25H,8-10H2,1-2H3
InChIKey
XWCFBCHIIIHCKU-UHFFFAOYSA-N
Synonyms
929835-72-3
5(3bromophenyl)6(13dihydroxy2(hydroxymethyl)propan2yl)13dimethyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
5(3bromophenyl)6(13dihydroxy2(hydroxymethyl)propan2yl)13dimethylpyrrolo(34d)pyrimidine24dione
929835723
CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC(=CC=C3)Br)C(CO)(CO)CO
InChI=1SC18H20BrN3O5c12013722(18(823924)1025)15(1143512(19)611)14(13)16(26)21(2)17(20)27h372325H810H212H3
MFCD09797393
ZINC000013681154
ZINC13681154

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Available files

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