Vitas-M small molecule compound

1-(4-{[1-(6-chloropyridazin-3-yl)piperidin-3-yl]carbonyl}piperazin-1-yl)ethanone

Catalog ID
STL317246
SMILES O=C(C1CCCN(C1)c1ccc(nn1)Cl)N1CCN(CC1)C(=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 C16H22ClN5O2 MW 351.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22ClN5O2/c1-12(23)20-7-9-21(10-8-20)16(24)13-3-2-6-22(11-13)15-5-4-14(17)18-19-15/h4-5,13H,2-3,6-11H2,1H3
InChIKey
DDMXCNPMWUPHNA-UHFFFAOYSA-N
Synonyms
1401561-48-5
1(4((1(6chloropyridazin3yl)piperidin3yl)carbonyl)piperazin1yl)ethanone
1(4(1(6chloropyridazin3yl)piperidine3carbonyl)piperazin1yl)ethanone
1401561485
CC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl
InChI=1SC16H22ClN5O2c112(23)207921(10820)16(24)1332622(1113)155414(17)181915h4513H23611H21H3
MFCD22584326
ZINC000079487099
ZINC000079487106

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Available files

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