Vitas-M small molecule compound
6-(azepan-1-ylmethyl)-3-hydroxy-1-methyl-2-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methyl)pyridin-4(1H)-one
Catalog ID
STL313209
SMILES Oc1c(=O)cc(n(c1CN1CCN(CC1)C/C=C/c1ccccc1)C)CN1CCCCCC1
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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 C27H38N4O2 MW 450.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N4O2/c1-28-24(21-30-13-7-2-3-8-14-30)20-26(32)27(33)25(28)22-31-18-16-29(17-19-31)15-9-12-23-10-5-4-6-11-23/h4-6,9-12,20,33H,2-3,7-8,13-19,21-22H2,1H3/b12-9+InChIKey
NAJXSDDYNCZHGO-FMIVXFBMSA-NSynonyms
1436016-33-9(E)6(azepan1ylmethyl)2((4cinnamylpiperazin1yl)methyl)3hydroxy1methylpyridin4(1H)one
1436016339
6(azepan1ylmethyl)3hydroxy1methyl2((4((2E)3phenylprop2en1yl)piperazin1yl)methyl)pyridin4(1H)one
6(azepan1ylmethyl)3hydroxy1methyl2((4((E)3phenylprop2enyl)piperazin1yl)methyl)pyridin4one
CN1C(=CC(=O)C(=C1CN2CCN(CC2)CC=CC3=CC=CC=C3)O)CN4CCCCCC4
InChI=1SC27H38N4O2c12824(21301372381430)2026(32)27(33)25(28)2231181629(171931)1591223105461123h469122033H237813192122H21H3b129+
MFCD23138283
Oc1c(=O)cc(n(c1CN1CCN(CC1)CC=Cc1ccccc1)C)CN1CCCCCC1
ZINC000095475348
ZINC95475348
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