Vitas-M small molecule compound
2-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-4-[(3-methoxyphenyl)amino]-4-oxobutanoic acid
Catalog ID
STL153782
SMILES COc1cccc(c1)NC(=O)CC(C(=O)O)CN1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C24H29N3O6 MW 455.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O6/c1-31-20-4-2-3-19(13-20)25-23(28)12-18(24(29)30)15-27-9-7-26(8-10-27)14-17-5-6-21-22(11-17)33-16-32-21/h2-6,11,13,18H,7-10,12,14-16H2,1H3,(H,25,28)(H,29,30)InChIKey
PMZXCLMJLAKKEI-UHFFFAOYSA-NSynonyms
1282128-35-11282128351
2((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)4((3methoxyphenyl)amino)4oxobutanoicacid
2((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)4(3methoxyanilino)4oxobutanoicacid
2((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methyl)4((3methoxyphenyl)amino)4oxobutanoicacid
COC1=CC=CC(=C1)NC(=O)CC(CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C(=O)O
InChI=1SC24H29N3O6c1312042319(1320)2523(28)1218(24(29)30)15279726(81027)1417562122(1117)33163221h26111318H710121416H21H3(H2528)(H2930)
MFCD18799643
ZINC000061721258
ZINC000061721259
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