Vitas-M small molecule compound
2-{2-[4-(3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL157565
SMILES COc1cccc(c1)N1CCN(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/c1-29-19-8-5-7-18(15-19)24-10-12-25(13-11-24)22(28)16-26-21(27)14-17-6-3-2-4-9-20(17)23-26/h5,7-8,14-15H,2-4,6,9-13,16H2,1H3InChIKey
FBAGCCJIJPFFMP-UHFFFAOYSA-NSynonyms
1282104-14-61282104146
2(2(4(3methoxyphenyl)piperazin1yl)2oxoethyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2(2(4(3methoxyphenyl)piperazin1yl)2oxoethyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
2(2(4(3methoxyphenyl)piperazin1yl)2oxoethyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
COC1=CC=CC(=C1)N2CCN(CC2)C(=O)CN3C(=O)C=C4CCCCCC4=N3
InChI=1SC22H28N4O3c1291985718(1519)24101225(131124)22(28)162621(27)14176324920(17)2326h5781415H24691316H21H3
MFCD18799954
ZINC000061721642
ZINC61721642
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