Vitas-M small molecule compound

4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}-4-oxobutanoic acid

Catalog ID
STL159872
SMILES COc1ccccc1N1CCN(CC1)CC(C(=O)O)CC(=O)Nc1ccc2c(c1)OCCO2

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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/c1-31-20-5-3-2-4-19(20)27-10-8-26(9-11-27)16-17(24(29)30)14-23(28)25-18-6-7-21-22(15-18)33-13-12-32-21/h2-7,15,17H,8-14,16H2,1H3,(H,25,28)(H,29,30)
InChIKey
HGZMTNHYMOBJEM-UHFFFAOYSA-N
Synonyms
1324086-59-0
1324086590
4((23dihydrobenzo(b)(14)dioxin6yl)amino)2((4(2methoxyphenyl)piperazin1yl)methyl)4oxobutanoicacid
4(23dihydro14benzodioxin6ylamino)2((4(2methoxyphenyl)piperazin1yl)methyl)4oxobutanoicacid
COC1=CC=CC=C1N2CCN(CC2)CC(CC(=O)NC3=CC4=C(C=C3)OCCO4)C(=O)O
InChI=1SC24H29N3O6c13120532419(20)2710826(91127)1617(24(29)30)1423(28)2518672122(1518)3313123221h271517H81416H21H3(H2528)(H2930)
MFCD19710028
ZINC000071282955
ZINC000071282956

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Available files

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