Vitas-M small molecule compound

4-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-8-methoxy-5H-pyrimido[5,4-b]indole

Catalog ID
STK538198
SMILES COc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)c1cc(Cl)ccc1C

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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 C22H22ClN5O MW 407.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O/c1-14-3-4-15(23)11-19(14)27-7-9-28(10-8-27)22-21-20(24-13-25-22)17-12-16(29-2)5-6-18(17)26-21/h3-6,11-13,26H,7-10H2,1-2H3
InChIKey
ZBDVTCCPXFXRLI-UHFFFAOYSA-N
Synonyms
370851-90-4
370851904
4(4(5chloro2methylphenyl)piperazin1yl)8methoxy5Hpyrimido(54b)indole
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NC=NC4=C3NC5=C4C=C(C=C5)OC
COc1ccc2c(c1)c1ncnc(c1(nH)2)N1CCN(CC1)c1cc(Cl)ccc1C
InChI=1SC22H22ClN5Oc1143415(23)1119(14)277928(10827)222120(24132522)171216(292)5618(17)2621h36111326H710H212H3
MFCD02999580
ZINC000002310026
ZINC02310026
ZINC2310026

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Available files

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