Vitas-M small molecule compound

2-{3-[4-(4-acetylphenyl)piperazin-1-yl]-3-oxopropyl}-6-phenylpyridazin-3(2H)-one

Catalog ID
STL127301
SMILES O=C(N1CCN(CC1)c1ccc(cc1)C(=O)C)CCn1nc(ccc1=O)c1ccccc1

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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 C25H26N4O3 MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O3/c1-19(30)20-7-9-22(10-8-20)27-15-17-28(18-16-27)24(31)13-14-29-25(32)12-11-23(26-29)21-5-3-2-4-6-21/h2-12H,13-18H2,1H3
InChIKey
LEDHUBWQGSJSBZ-UHFFFAOYSA-N
Synonyms

2(3(4(4acetylphenyl)piperazin1yl)3oxopropyl)6phenylpyridazin3(2H)one
2(3(4(4acetylphenyl)piperazin1yl)3oxopropyl)6phenylpyridazin3one
CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCN3C(=O)C=CC(=N3)C4=CC=CC=C4
InChI=1SC25H26N4O3c119(30)207922(10820)27151728(181627)24(31)13142925(32)121123(2629)215324621h212H1318H21H3
MFCD20740219
ZINC000041251831
ZINC41251831

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Available files

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