Vitas-M small molecule compound

6-(1H-benzimidazol-6-yl)-5-(3,4-dimethoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione

Catalog ID
STK657067
SMILES COc1cc(ccc1OC)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccc2c(c1)[nH]cn2

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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 C23H21N5O4 MW 431.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5O4/c1-26-17-11-28(14-6-7-15-16(10-14)25-12-24-15)21(20(17)22(29)27(2)23(26)30)13-5-8-18(31-3)19(9-13)32-4/h5-12H,1-4H3,(H,24,25)
InChIKey
LGFXNPIUJUAYFX-UHFFFAOYSA-N
Synonyms
1081130-57-5
1081130575
6(1Hbenzimidazol6yl)5(34dimethoxyphenyl)13dimethyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
6(1Hbenzo(d)imidazol5yl)5(34dimethoxyphenyl)13dimethyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
6(3Hbenzimidazol5yl)5(34dimethoxyphenyl)13dimethylpyrrolo(34d)pyrimidine24dione
CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC(=C(C=C3)OC)OC)C4=CC5=C(C=C4)N=CN5
COc1cc(ccc1OC)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccc2c(c1)(nH)cn2
COc1cc(ccc1OC)c1n(cc2c1c(=O)n(C)c(=O)n2C)c1ccc2c(c1)nc(nH)2
InChI=1SC23H21N5O4c126171128(14671516(1014)25122415)21(20(17)22(29)27(2)23(26)30)135818(313)19(913)324h512H14H3(H2425)
MFCD18167906
ZINC000020719220
ZINC20719220

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Available files

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