Vitas-M small molecule compound

[4-(tert-butoxycarbonyl)piperazin-1-yl]{6-[(phenylcarbonyl)amino]-1H-indol-3-yl}acetic acid

Catalog ID
STK658013
SMILES OC(=O)C(c1c[nH]c2c1ccc(c2)NC(=O)c1ccccc1)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 C26H30N4O5 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O5/c1-26(2,3)35-25(34)30-13-11-29(12-14-30)22(24(32)33)20-16-27-21-15-18(9-10-19(20)21)28-23(31)17-7-5-4-6-8-17/h4-10,15-16,22,27H,11-14H2,1-3H3,(H,28,31)(H,32,33)
InChIKey
OFIZBNOKAGPFHK-UHFFFAOYSA-N
Synonyms
1214805-94-3
(4(tertbutoxycarbonyl)piperazin1yl)(6((phenylcarbonyl)amino)1Hindol3yl)aceticacid
1214805943
2(6benzamido1Hindol3yl)2(4((2methylpropan2yl)oxycarbonyl)piperazin1yl)aceticacid
2(6benzamido1Hindol3yl)2(4(tertbutoxycarbonyl)piperazin1yl)aceticacid
CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CNC3=C2C=CC(=C3)NC(=O)C4=CC=CC=C4)C(=O)O
InChI=1SC26H30N4O5c126(23)3525(34)30131129(121430)22(24(32)33)201627211518(91019(20)21)2823(31)177546817h41015162227H1114H213H3(H2831)(H3233)
MFCD13757148
OC(=O)C(c1c(nH)c2c1ccc(c2)NC(=O)c1ccccc1)N1CCN(CC1)C(=O)OC(C)(C)C
ZINC000036357468
ZINC000036357469

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Available files

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