Vitas-M small molecule compound
2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL152292
SMILES COc1ccccc1N1CCN(CC1)C(=O)Cn1nc2CCCCCc2cc1=O
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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 C22H28N4O3 MW 396.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O3/c1-29-20-10-6-5-9-19(20)24-11-13-25(14-12-24)22(28)16-26-21(27)15-17-7-3-2-4-8-18(17)23-26/h5-6,9-10,15H,2-4,7-8,11-14,16H2,1H3InChIKey
BXHBXJRYVCVVTP-UHFFFAOYSA-NSynonyms
1324059-43-91324059439
2(2(4(2methoxyphenyl)piperazin1yl)2oxoethyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2(2(4(2methoxyphenyl)piperazin1yl)2oxoethyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
2(2(4(2methoxyphenyl)piperazin1yl)2oxoethyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
COC1=CC=CC=C1N2CCN(CC2)C(=O)CN3C(=O)C=C4CCCCCC4=N3
InChI=1SC22H28N4O3c129201065919(20)24111325(141224)22(28)162621(27)15177324818(17)2326h5691015H2478111416H21H3
MFCD19708920
ZINC000071280392
ZINC71280392
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