Basic information
- CAS
821784-40-1- Standard SMILES
COc1ccc(Nc2cncc(-c3cccc(O)c3)c2)cc1- InChIKey
IUZKQQXPXLIICJ-UHFFFAOYSA-N- Molecular formula
- C18H16N2O2
- Average molar mass
- 292.3 g/mol
- Monoisotopic mass
- 292.12117776
Names & identifiers
- Preferred name
- Phenol, 3-[5-[(4-methoxyphenyl)amino]-3-pyridinyl]-
- IUPAC
- 3-[5-(4-methoxyanilino)-3-pyridinyl]phenol
Names & synonyms
821784-40-1Phenol, 3-[5-[(4-methoxyphenyl)amino]-3-pyridinyl]-3-[5-(4-methoxyanilino)pyridin-3-yl]phenolSCHEMBL4143146DTXSID30470535
Database identifiers
- CAS
821784-40-1- PubChem CID
- 11680868
- DTXSID
DTXSID30470535
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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