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2-(2-methyl-5-nitroimidazol-1-yl)-N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]acetamide

HCID 370830
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
154094-96-9
Standard SMILES
Cc1ncc([N+](=O)[O-])n1CCNC(=O)Cn1c([N+](=O)[O-])cnc1C
InChIKey
KMCIIMXLGQMJCT-UHFFFAOYSA-N
Molecular formula
C12H15N7O5
Average molar mass
337.29 g/mol
Monoisotopic mass
337.1134666

Names & identifiers

Preferred name
2-(2-methyl-5-nitroimidazol-1-yl)-N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]acetamide
IUPAC
2-(2-methyl-5-nitroimidazol-1-yl)-N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]acetamide
English name
2-[2-methyl-3-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-5-nitro-2H-imi dazol-1-yl]acetamide
Molecular formula
C12H15N7O5
Molecular weight
337.29

Names & synonyms

154094-96-9NSC6444962-Methyl-N-(2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl)-5-nitro-1H-imidazole-1-acetamide2-(2-methyl-5-nitroimidazol-1-yl)-N-[2-(2-methyl-5-nitroimidazol-1-yl)ethyl]acetamideCHEMBL127976DTXSID90934921NSC-6444962-[2-METHYL-3-[2-(2-METHYL-5-NITRO-IMIDAZOL-1-YL)ETHYL]-5-NITRO-2H-IMI DAZOL-1-YL]ACETAMIDENCI60_0150632-(2-methyl-5-nitro-imidazol-1-yl)-N-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]acetamide(2-Methyl-5-nitro-1H-imidazol-1-yl)-N-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]ethanimidic acid2-(2-Methyl-5-nitro-1H-imidazol-1-yl)-N-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]ethanimidic acid
Show more names
1H-Imidazole-1-acetamide, 2-methyl-N-[2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl]-5-nitro-
2-(2-Methyl-5-nitro-imidazol-1-yl)-N-[2-(2-methyl-5-nitro-imidazol-1-yl)-ethyl]-acetamide

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
156 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
24
Formal charge
0
Complexity
493

Chemistry & industry

Suppliers2 total

HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
154094-96-9
PubChem CID
370830
DTXSID
DTXSID90934921
ChEMBL
CHEMBL127976
Nikkaji
J578.206F