Vitas-M small molecule compound
tert-butyl 4-{[6-(azepan-1-ylmethyl)-3-hydroxy-4-oxo-4H-pyran-2-yl]methyl}piperazine-1-carboxylate
Catalog ID
STL422902
SMILES O=C(N1CCN(CC1)Cc1oc(CN2CCCCCC2)cc(=O)c1O)OC(C)(C)C
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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 C22H35N3O5 MW 421.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H35N3O5/c1-22(2,3)30-21(28)25-12-10-24(11-13-25)16-19-20(27)18(26)14-17(29-19)15-23-8-6-4-5-7-9-23/h14,27H,4-13,15-16H2,1-3H3InChIKey
INSUNGZJXNWWFT-UHFFFAOYSA-NSynonyms
1630905-57-51630905575
CC(C)(C)OC(=O)N1CCN(CC1)CC2=C(C(=O)C=C(O2)CN3CCCCCC3)O
InChI=1SC22H35N3O5c122(23)3021(28)25121024(111325)161920(27)18(26)1417(2919)152386457923h1427H4131516H213H3
MFCD28368254
tertbutyl4((6(azepan1ylmethyl)3hydroxy4oxo4Hpyran2yl)methyl)piperazine1carboxylate
tertbutyl4((6(azepan1ylmethyl)3hydroxy4oxopyran2yl)methyl)piperazine1carboxylate
ZINC000218391243
ZINC218391243
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