Basic information
- CAS
154094-88-9- Standard SMILES
O=C(CCn1ccnc1[N+](=O)[O-])NCCCn1ccnc1[N+](=O)[O-]- InChIKey
QKWIUUWNGGRAKM-UHFFFAOYSA-N- Molecular formula
- C12H15N7O5
- Average molar mass
- 337.29 g/mol
- Monoisotopic mass
- 337.1134666
Names & identifiers
- Preferred name
- 2-Nitro-N-(3-(2-nitro-1H-imidazol-1-yl)propyl)-1H-imidazole-1-propanamide
- IUPAC
- 3-(2-nitroimidazol-1-yl)-N-[3-(2-nitroimidazol-1-yl)propyl]propanamide
- English name
- N-[2-nitro-3-[3-(2-nitroimidazol-1-yl)propyl]-2H-imidazol-1-yl]propana mide
- Molecular formula
- C12H15N7O5
- Molecular weight
- 337.29
Names & synonyms
154094-88-9NSC6555503-(2-nitroimidazol-1-yl)-N-[3-(2-nitroimidazol-1-yl)propyl]propanamide2-Nitro-N-(3-(2-nitro-1H-imidazol-1-yl)propyl)-1H-imidazole-1-propanamideCHEMBL129041DTXSID60934913NSC-655550N-[2-NITRO-3-[3-(2-NITROIMIDAZOL-1-YL)PROPYL]-2H-IMIDAZOL-1-YL]PROPANA MIDENCI60_019303N-[3-(2-nitroimidazol-1H-yl)propyl]-3-(2-nitroimidazol-1H- yl)propanamide{N-[3-(2-Nitroimidazol-1H-yl)propyl]-3-(2-nitroimidazol-1H-} yl)propanamide3-(2-Nitro-1H-imidazol-1-yl)-N-[3-(2-nitro-1H-imidazol-1-yl)propyl]propanimidic acid
Show more names
1H-Imidazole-1-propanamide, 2-nitro-N-[3-(2-nitro-1H-imidazol-1-yl)propyl]-
3-(2-(Hydroxy(oxido)amino)-1H-imidazol-1-yl)-N-(3-(2-(hydroxy(oxido)amino)-1H-imidazol-1-yl)propyl)propanamide
Database identifiers
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 466
Chemistry & industry
Suppliers2 total
HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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