Vitas-M small molecule compound
7,7-dimethyl-2-phenyl-4-(2,4,5-trimethoxyphenyl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333435
SMILES COc1cc(OC)c(cc1C1C2=C(Nc3c1c(=O)n([nH]3)c1ccccc1)CC(CC2=O)(C)C)OC
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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 C27H29N3O5 MW 475.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O5/c1-27(2)13-17-23(18(31)14-27)22(16-11-20(34-4)21(35-5)12-19(16)33-3)24-25(28-17)29-30(26(24)32)15-9-7-6-8-10-15/h6-12,22,28-29H,13-14H2,1-5H3InChIKey
LQOFWYSQVALTGH-UHFFFAOYSA-NSynonyms
77dimethyl2phenyl4(245trimethoxyphenyl)4689tetrahydro1Hpyrazolo(34b)quinoline35dione
77dimethyl2phenyl4(245trimethoxyphenyl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC(=C(C=C5OC)OC)OC)C(=O)C1)C
COc1cc(OC)c(cc1C1C2=C(Nc3c1c(=O)n((nH)3)c1ccccc1)CC(CC2=O)(C)C)OC
InChI=1SC27H29N3O5c127(2)131723(18(31)1427)22(161120(344)21(355)1219(16)333)2425(2817)2930(26(24)32)1597681015h612222829H1314H215H3
MFCD09963053
ZINC000102046274
ZINC000102046280
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