4H-Imidazol-4-one, 3,5-dihydro-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-(phenylmethylene)-
Basic information
- CAS
78311-84-9- Standard SMILES
COc1cc([N+](=O)[O-])ccc1N1C(=O)/C(=C/c2ccccc2)N=C1C- InChIKey
BPZQYIGTDBXQCV-GDNBJRDFSA-N- Molecular formula
- C18H15N3O4
- Average molar mass
- 337.3 g/mol
- Monoisotopic mass
- 337.10625597
Names & identifiers
- Preferred name
- 4H-Imidazol-4-one, 3,5-dihydro-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-(phenylmethylene)-
- IUPAC
- (5Z)-5-benzylidene-3-(2-methoxy-4-nitrophenyl)-2-methylimidazol-4-one
Names & synonyms
4H-Imidazol-4-one, 3,5-dihydro-3-(2-methoxy-4-nitrophenyl)-2-methyl-5-(phenylmethylene)-78311-84-9RefChem:10719473-(2-Methoxy-4-nitrophenyl)-2-methyl-5-(phenylmethylene)-3,5-dihydro-4H-imidazol-4-one
Database identifiers
- CAS
78311-84-9- PubChem CID
- 6447589
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 590
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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