Vitas-M small molecule compound
2-[(4-benzylpiperazin-1-yl)methyl]-2,5,6,7,8,9-hexahydro-3H-cyclohepta[c]pyridazin-3-one
Catalog ID
STL243093
SMILES O=c1cc2CCCCCc2nn1CN1CCN(CC1)Cc1ccccc1
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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 C21H28N4O MW 352.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O/c26-21-15-19-9-5-2-6-10-20(19)22-25(21)17-24-13-11-23(12-14-24)16-18-7-3-1-4-8-18/h1,3-4,7-8,15H,2,5-6,9-14,16-17H2InChIKey
SHRXTGHZKRSSFK-UHFFFAOYSA-NSynonyms
1374537-11-71374537117
2((4benzylpiperazin1yl)methyl)256789hexahydro3Hcyclohepta(c)pyridazin3one
2((4benzylpiperazin1yl)methyl)6789tetrahydro2Hcyclohepta(c)pyridazin3(5H)one
2((4benzylpiperazin1yl)methyl)6789tetrahydro5Hcyclohepta(c)pyridazin3one
C1CCC2=CC(=O)N(N=C2CC1)CN3CCN(CC3)CC4=CC=CC=C4
InChI=1SC21H28N4Oc2621151995261020(19)2225(21)1724131123(121424)16187314818h1347815H2569141617H2
MFCD22204013
ZINC000072405672
ZINC72405672
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