Vitas-M small molecule compound
3-{[4-(tert-butoxycarbonyl)piperazin-1-yl](carboxy)methyl}-1-methyl-1H-indole-2-carboxylic acid
Catalog ID
STK933429
SMILES OC(=O)C(c1c(C(=O)O)n(c2c1cccc2)C)N1CCN(CC1)C(=O)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 C21H27N3O6 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O6/c1-21(2,3)30-20(29)24-11-9-23(10-12-24)17(19(27)28)15-13-7-5-6-8-14(13)22(4)16(15)18(25)26/h5-8,17H,9-12H2,1-4H3,(H,25,26)(H,27,28)InChIKey
IDHFXTGKRMMDPW-UHFFFAOYSA-NSynonyms
1214829-83-01214829830
3((4(tertbutoxycarbonyl)piperazin1yl)(carboxy)methyl)1methyl1Hindole2carboxylicacid
3(carboxy(4((2methylpropan2yl)oxycarbonyl)piperazin1yl)methyl)1methylindole2carboxylicacid
CC(C)(C)OC(=O)N1CCN(CC1)C(C2=C(N(C3=CC=CC=C32)C)C(=O)O)C(=O)O
InChI=1SC21H27N3O6c121(23)3020(29)2411923(101224)17(19(27)28)1513756814(13)22(4)16(15)18(25)26h5817H912H214H3(H2526)(H2728)
MFCD13760036
ZINC000036360952
ZINC000036360953
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