Vitas-M small molecule compound

3-[2-(tritylamino)ethyl]-1H-indol-5-yl 6-{[(benzyloxy)carbonyl]amino}hexanoate

Catalog ID
STK366238
SMILES O=C(OCc1ccccc1)NCCCCCC(=O)Oc1ccc2c(c1)c(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)c[nH]2

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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 C43H43N3O4 MW 665.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H43N3O4/c47-41(24-14-5-15-28-44-42(48)49-32-33-16-6-1-7-17-33)50-38-25-26-40-39(30-38)34(31-45-40)27-29-46-43(35-18-8-2-9-19-35,36-20-10-3-11-21-36)37-22-12-4-13-23-37/h1-4,6-13,16-23,25-26,30-31,45-46H,5,14-15,24,27-29,32H2,(H,44,48)
InChIKey
ODUMKZCGLZKICP-UHFFFAOYSA-N
Synonyms
54430-85-2
(3(2(TRITYLAMINO)ETHYL)1HINDOL5YL)6(PHENYLMETHOXYCARBONYLAMINO)HEXANOATE
3(2((TRIPHENYLMETHYL)AMINO)ETHYL)INDOL5YL6((PHENYLMETHOXY)CARBONYLAMINO)HEXANOATE
3(2(tritylamino)ethyl)1Hindol5yl6(((benzyloxy)carbonyl)amino)hexanoate
54430852
C1=CC=C(C=C1)COC(=O)NCCCCCC(=O)OC2=CC3=C(C=C2)NC=C3CCNC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC43H43N3O4c4741(2414515284442(48)493233166171733)503825264039(3038)34(314540)27294643(351882919353620103112136)3722124132337h146131623252630314546H5141524272932H2(H4448)
MFCD00308279
O=C(OCc1ccccc1)NCCCCCC(=O)Oc1ccc2c(c1)c(CCNC(c1ccccc1)(c1ccccc1)c1ccccc1)c(nH)2
ZINC000004014906
ZINC4014906

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Available files

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