Vitas-M small molecule compound

5-(2-chloro-4-fluorobenzyl)-3-(2-methoxybenzyl)-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

Catalog ID
STL135190
SMILES COc1ccccc1Cn1cnc2c(c1=O)n(Cc1ccc(cc1Cl)F)c1c2cc(cc1)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 C26H21ClFN3O2 MW 461.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21ClFN3O2/c1-16-7-10-22-20(11-16)24-25(31(22)14-17-8-9-19(28)12-21(17)27)26(32)30(15-29-24)13-18-5-3-4-6-23(18)33-2/h3-12,15H,13-14H2,1-2H3
InChIKey
HRECRNWKPSNVHY-UHFFFAOYSA-N
Synonyms
1190005-09-4
1190005094
5((2chloro4fluorophenyl)methyl)3((2methoxyphenyl)methyl)8methylpyrimido(54b)indol4one
5(2chloro4fluorobenzyl)3(2methoxybenzyl)8methyl35dihydro4Hpyrimido(54b)indol4one
5(2CHLORO4FLUOROBENZYL)3(2METHOXYBENZYL)8METHYL3HPYRIMIDO(54B)INDOL4(5H)ONE
CC1=CC2=C(C=C1)N(C3=C2N=CN(C3=O)CC4=CC=CC=C4OC)CC5=C(C=C(C=C5)F)Cl
InChI=1SC26H21ClFN3O2c1167102220(1116)2425(31(22)14178919(28)1221(17)27)26(32)30(152924)1318534623(18)332h31215H1314H212H3
MFCD20754177
ZINC000035400692
ZINC35400692

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Available files

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