Vitas-M small molecule compound

methyl 4-({[4-(4-bromophenyl)-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridin-5-yl]carbonyl}amino)butanoate

Catalog ID
STK659962
SMILES COC(=O)CCCNC(=O)N1CCc2c(C1c1ccc(cc1)Br)nc[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 C18H21BrN4O3 MW 421.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21BrN4O3/c1-26-15(24)3-2-9-20-18(25)23-10-8-14-16(22-11-21-14)17(23)12-4-6-13(19)7-5-12/h4-7,11,17H,2-3,8-10H2,1H3,(H,20,25)(H,21,22)
InChIKey
QMHRFUQMQODKKP-UHFFFAOYSA-N
Synonyms
1040692-92-9
1040692929
COC(=O)CCCNC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Br)N=CN2
COC(=O)CCCNC(=O)N1CCc2c(C1c1ccc(cc1)Br)(nH)cn2
COC(=O)CCCNC(=O)N1CCc2c(C1c1ccc(cc1)Br)nc(nH)2
InChI=1SC18H21BrN4O3c12615(24)3292018(25)231081416(22112114)17(23)124613(19)7512h471117H23810H21H3(H2025)(H2122)
methyl4(((4(4bromophenyl)1467tetrahydro5Himidazo(45c)pyridin5yl)carbonyl)amino)butanoate
methyl4((4(4bromophenyl)1467tetrahydroimidazo(45c)pyridine5carbonyl)amino)butanoate
methyl4(4(4bromophenyl)4567tetrahydro3Himidazo(45c)pyridine5carboxamido)butanoate
MFCD18168901
ZINC000031807552
ZINC000031807560

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Available files

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