Basic information
- CAS
203940-06-1- Standard SMILES
C(=Nc1ccc(Oc2ccc(N=Cc3ccc[nH]3)cc2)cc1)c1ccc[nH]1- InChIKey
IMZGKZUYSJRWJW-UHFFFAOYSA-N- Molecular formula
- C22H18N4O
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.14806121
Names & identifiers
- Preferred name
- 4,4'-Oxybis{N-[(2H-pyrrol-2-ylidene)methyl]aniline}
- IUPAC
- 1-(1H-pyrrol-2-yl)-N-[4-[4-(1H-pyrrol-2-ylmethylideneamino)phenoxy]phenyl]methanimine
Names & synonyms
203940-06-14,4'-Oxybis{N-[(2H-pyrrol-2-ylidene)methyl]aniline}DTXSID90781391
Database identifiers
- CAS
203940-06-1- PubChem CID
- 136239727
- DTXSID
DTXSID90781391- Nikkaji
- J2.077.952G
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 449
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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