Vitas-M small molecule compound
5-(4-tert-butylbenzyl)-3-(2-chlorobenzyl)-8-fluoro-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL184090
SMILES Fc1ccc2c(c1)c1ncn(c(=O)c1n2Cc1ccc(cc1)C(C)(C)C)Cc1ccccc1Cl
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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 C28H25ClFN3O MW 473.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClFN3O/c1-28(2,3)20-10-8-18(9-11-20)15-33-24-13-12-21(30)14-22(24)25-26(33)27(34)32(17-31-25)16-19-6-4-5-7-23(19)29/h4-14,17H,15-16H2,1-3H3InChIKey
LMZWTEGAWRMBOK-UHFFFAOYSA-NSynonyms
5((4tertbutylphenyl)methyl)3((2chlorophenyl)methyl)8fluoropyrimido(54b)indol4one
5(4tertbutylbenzyl)3(2chlorobenzyl)8fluoro35dihydro4Hpyrimido(54b)indol4one
CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)F)C4=C2C(=O)N(C=N4)CC5=CC=CC=C5Cl
InChI=1SC28H25ClFN3Oc128(23)2010818(91120)153324131221(30)1422(24)2526(33)27(34)32(173125)1619645723(19)29h41417H1516H213H3
MFCD22386232
ZINC000072328616
ZINC72328616
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