Vitas-M small molecule compound
6-{[4-(2,3-dihydro-1,4-benzodioxin-2-ylcarbonyl)piperazin-1-yl]methyl}-4,4,9-trimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Catalog ID
STL445049
SMILES O=C(C1COc2c(O1)cccc2)N1CCN(CC1)CC1=CC(C)(C)N2c3c1ccc(c3C(=O)C2=O)C
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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 C28H29N3O5 MW 487.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O5/c1-17-8-9-19-18(14-28(2,3)31-24(19)23(17)25(32)27(31)34)15-29-10-12-30(13-11-29)26(33)22-16-35-20-6-4-5-7-21(20)36-22/h4-9,14,22H,10-13,15-16H2,1-3H3InChIKey
YNKFVJITZAUHNU-UHFFFAOYSA-NSynonyms
6((4(23dihydro14benzodioxin2ylcarbonyl)piperazin1yl)methyl)449trimethyl4Hpyrrolo(321ij)quinoline12dione
CC1=C2C3=C(C=C1)C(=CC(N3C(=O)C2=O)(C)C)CN4CCN(CC4)C(=O)C5COC6=CC=CC=C6O5
InChI=1SC28H29N3O5c117891918(1428(23)3124(19)23(17)25(32)27(31)34)1529101230(131129)26(33)22163520645721(20)3622h491422H10131516H213H3
MFCD30712842
ZINC000253495995
ZINC000253495996
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