Vitas-M small molecule compound
2-[(4-acetylpiperazin-1-yl)methyl]-4-(1,3-benzodioxol-5-ylamino)-4-oxobutanoic acid
Catalog ID
STL247805
SMILES O=C(CC(C(=O)O)CN1CCN(CC1)C(=O)C)Nc1ccc2c(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 C18H23N3O6 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O6/c1-12(22)21-6-4-20(5-7-21)10-13(18(24)25)8-17(23)19-14-2-3-15-16(9-14)27-11-26-15/h2-3,9,13H,4-8,10-11H2,1H3,(H,19,23)(H,24,25)InChIKey
UEUVMENDBJJBOA-UHFFFAOYSA-NSynonyms
1374529-36-81374529368
2((4acetylpiperazin1yl)methyl)4(13benzodioxol5ylamino)4oxobutanoicacid
2((4acetylpiperazin1yl)methyl)4(benzo(d)(13)dioxol5ylamino)4oxobutanoicacid
CC(=O)N1CCN(CC1)CC(CC(=O)NC2=CC3=C(C=C2)OCO3)C(=O)O
InChI=1SC18H23N3O6c112(22)216420(5721)1013(18(24)25)817(23)1914231516(914)27112615h23913H481011H21H3(H1923)(H2425)
MFCD22204175
ZINC000072405877
ZINC000072405878
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