1-(2-Nitroimidazol-1-yl)-3-(2-phenylaziridin-1-yl)propan-2-ol
Basic information
- CAS
88876-93-1- Standard SMILES
O=[N+]([O-])c1nccn1CC(O)CN1CC1c1ccccc1- InChIKey
OOWNPQWUVIKWET-UHFFFAOYSA-N- Molecular formula
- C14H16N4O3
- Average molar mass
- 288.3 g/mol
- Monoisotopic mass
- 288.12224039
Names & identifiers
- Preferred name
- 1-(2-Nitroimidazol-1-yl)-3-(2-phenylaziridin-1-yl)propan-2-ol
- IUPAC
- 1-(2-nitroimidazol-1-yl)-3-(2-phenylaziridin-1-yl)propan-2-ol
Names & synonyms
88876-93-1NSC3628061-(2-nitroimidazol-1-yl)-3-(2-phenylaziridin-1-yl)propan-2-olDTXSID50320644NSC-3628061-(2-Nitro-1H-imidazol-1-yl)-3-(2-phenylaziridin-1-yl)propan-2-ol
Database identifiers
- CAS
88876-93-1- PubChem CID
- 338770
- DTXSID
DTXSID50320644
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 86.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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