Vitas-M small molecule compound
[4-(2-{[2-(dimethylamino)ethyl]amino}-2-oxoethyl)piperazin-1-yl][5-(hydroxymethyl)-1H-indol-3-yl]acetic acid
Catalog ID
STK652953
SMILES OCc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)CC(=O)NCCN(C)C)C(=O)O
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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 C21H31N5O4 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N5O4/c1-24(2)6-5-22-19(28)13-25-7-9-26(10-8-25)20(21(29)30)17-12-23-18-4-3-15(14-27)11-16(17)18/h3-4,11-12,20,23,27H,5-10,13-14H2,1-2H3,(H,22,28)(H,29,30)InChIKey
VWMWJDIXQCOOBA-UHFFFAOYSA-NSynonyms
1144448-33-8(4(2((2(dimethylamino)ethyl)amino)2oxoethyl)piperazin1yl)(5(hydroxymethyl)1Hindol3yl)aceticacid
1144448338
2(4(2((2(dimethylamino)ethyl)amino)2oxoethyl)piperazin1yl)2(5(hydroxymethyl)1Hindol3yl)aceticacid
2(4(2(2(dimethylamino)ethylamino)2oxoethyl)piperazin1yl)2(5(hydroxymethyl)1Hindol3yl)aceticacid
CN(C)CCNC(=O)CN1CCN(CC1)C(C2=CNC3=C2C=C(C=C3)CO)C(=O)O
InChI=1SC21H31N5O4c124(2)652219(28)13257926(10825)20(21(29)30)171223184315(1427)1116(17)18h341112202327H5101314H212H3(H2228)(H2930)
MFCD12215759
OCc1ccc2c(c1)c(c(nH)2)C(N1CCN(CC1)CC(=O)NCCN(C)C)C(=O)O
ZINC000031815370
ZINC000031815375
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