Vitas-M small molecule compound

5,5-dimethyl-2-({[2-(4-propanoylpiperazin-1-yl)ethyl]amino}methylidene)cyclohexane-1,3-dione

Catalog ID
STK071860
SMILES CCC(=O)N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)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 C18H29N3O3 MW 335.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H29N3O3/c1-4-17(24)21-9-7-20(8-10-21)6-5-19-13-14-15(22)11-18(2,3)12-16(14)23/h13,19H,4-12H2,1-3H3
InChIKey
OKXPLZJOJCUANU-UHFFFAOYSA-N
Synonyms

55DIMETHYL2(((2(4PROPANOYLPIPERAZIN1YL)ETHYL)AMINO)METHYLIDENE)CYCLOHEXANE13DIONE
55dimethyl2(((2(4propionylpiperazin1yl)ethyl)amino)methylene)cyclohexane13dione
55DIMETHYL2((2(4(1OXOPROPYL)1PIPERAZINYL)ETHYLAMINO)METHYLIDENE)CYCLOHEXANE13DIONE
55DIMETHYL2((2(4PROPANOYLPIPERAZIN1YL)ETHYLAMINO)METHYLIDENE)CYCLOHEXANE13DIONE
55DIMETHYL2((2(4PROPIONYLPIPERAZINO)ETHYLAMINO)METHYLENE)CYCLOHEXANE13QUINONE
CCC(=O)N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)C
CCC(=O)N1CCN(CC1)CCNC=C2C(=O)CC(CC2=O)(C)C
InChI=1SC18H29N3O3c1417(24)219720(81021)6519131415(22)1118(23)1216(14)23h1319H412H213H3
MFCD00815042
STK071860
ZINC000100399277
ZINC100399277

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.