Vitas-M small molecule compound

tert-butyl (4-{[4-(pyrimidin-2-yl)piperazin-1-yl]carbonyl}benzyl)carbamate

Catalog ID
STL350757
SMILES O=C(c1ccc(cc1)CNC(=O)OC(C)(C)C)N1CCN(CC1)c1ncccn1

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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 C21H27N5O3 MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3/c1-21(2,3)29-20(28)24-15-16-5-7-17(8-6-16)18(27)25-11-13-26(14-12-25)19-22-9-4-10-23-19/h4-10H,11-15H2,1-3H3,(H,24,28)
InChIKey
LFZNITMNJREOCM-UHFFFAOYSA-N
Synonyms
951933-72-5
951933725
CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3
InChI=1SC21H27N5O3c121(23)2920(28)2415165717(8616)18(27)25111326(141225)192294102319h410H1115H213H3(H2428)
MFCD09850599
tertbutyl(4((4(pyrimidin2yl)piperazin1yl)carbonyl)benzyl)carbamate
tertbutyl4(4(pyrimidin2yl)piperazine1carbonyl)benzylcarbamate
tertbutylN((4(4pyrimidin2ylpiperazine1carbonyl)phenyl)methyl)carbamate
ZINC000013688009
ZINC13688009

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.