Vitas-M small molecule compound

[4-(tert-butoxycarbonyl)piperazin-1-yl]{5-[(2-methylpropanoyl)amino]-1H-indol-3-yl}acetic acid

Catalog ID
STK660349
SMILES OC(=O)C(c1c[nH]c2c1cc(cc2)NC(=O)C(C)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 C23H32N4O5 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N4O5/c1-14(2)20(28)25-15-6-7-18-16(12-15)17(13-24-18)19(21(29)30)26-8-10-27(11-9-26)22(31)32-23(3,4)5/h6-7,12-14,19,24H,8-11H2,1-5H3,(H,25,28)(H,29,30)
InChIKey
SEGWQYASHUGXTI-UHFFFAOYSA-N
Synonyms
1214195-75-1
(4(tertbutoxycarbonyl)piperazin1yl)(5((2methylpropanoyl)amino)1Hindol3yl)aceticacid
1214195751
2(4(tertbutoxycarbonyl)piperazin1yl)2(5isobutyramido1Hindol3yl)aceticacid
2(5(2methylpropanoylamino)1Hindol3yl)2(4((2methylpropan2yl)oxycarbonyl)piperazin1yl)aceticacid
CC(C)C(=O)NC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)C(=O)OC(C)(C)C
InChI=1SC23H32N4O5c114(2)20(28)2515671816(1215)17(132418)19(21(29)30)2681027(11926)22(31)3223(34)5h6712141924H811H215H3(H2528)(H2930)
MFCD13755631
OC(=O)C(c1c(nH)c2c1cc(cc2)NC(=O)C(C)C)N1CCN(CC1)C(=O)OC(C)(C)C
ZINC000036353018
ZINC000036353019

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Available files

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