Vitas-M small molecule compound

N-cyclododecyl-5-nitropyrimidine-4,6-diamine

Catalog ID
STK944324
SMILES Nc1ncnc(c1[N+](=O)[O-])NC1CCCCCCCCCCC1

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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 C16H27N5O2 MW 321.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H27N5O2/c17-15-14(21(22)23)16(19-12-18-15)20-13-10-8-6-4-2-1-3-5-7-9-11-13/h12-13H,1-11H2,(H3,17,18,19,20)
InChIKey
BPEAUVRBARHFMV-UHFFFAOYSA-N
Synonyms
450344-86-2
450344862
4NCYCLODODECYL5NITROPYRIMIDINE46DIAMINE
C1CCCCCC(CCCCC1)NC2=NC=NC(=C2(N+)(=O)(O))N
InChI=1SC16H27N5O2c171514(21(22)23)16(19121815)2013108642135791113h1213H111H2(H317181920)
MFCD04453034
N4CYCLODODECYL5NITROPYRIMIDINE46DIAMINE
Nc1ncnc(c1(N+)(=O)(O))NC1CCCCCCCCCCC1
Ncyclododecyl5nitropyrimidine46diamine
ZINC000003912517
ZINC03912517
ZINC3912517

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Available files

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