Vitas-M small molecule compound

tert-butyl 4-[3-(4-bromo-5-methyl-1H-pyrazol-1-yl)propanoyl]piperazine-1-carboxylate

Catalog ID
STL397803
SMILES O=C(N1CCN(CC1)C(=O)OC(C)(C)C)CCn1ncc(c1C)Br

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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 C16H25BrN4O3 MW 401.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H25BrN4O3/c1-12-13(17)11-18-21(12)6-5-14(22)19-7-9-20(10-8-19)15(23)24-16(2,3)4/h11H,5-10H2,1-4H3
InChIKey
MMYZVHRYYWFDRV-UHFFFAOYSA-N
Synonyms
1005649-75-1
1005649751
CC1=C(C=NN1CCC(=O)N2CCN(CC2)C(=O)OC(C)(C)C)Br
InChI=1SC16H25BrN4O3c11213(17)111821(12)6514(22)197920(10819)15(23)2416(23)4h11H510H214H3
MFCD04053021
TERTBUTYL4(3(4BROMO5METHYL1HPYRAZOL1YL)PROPANOYL)PIPERAZINE1CARBOXYLATE
TERTBUTYL4(3(4BROMO5METHYLPYRAZOL1YL)PROPANOYL)PIPERAZINE1CARBOXYLATE
ZINC000002802347
ZINC02802347
ZINC2802347

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Available files

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