Basic information
- Standard SMILES
Nc1cc(-c2nc3ccccc3o2)ccc1NCc1ccccc1- InChIKey
IQFGFKHRQWQPAK-UHFFFAOYSA-N- Molecular formula
- C20H17N3O
- Average molar mass
- 315.4 g/mol
Names & identifiers
- Preferred name
- 2-(2-Benzylaminoanilin-5-yl)benzoxazole
- IUPAC
- 4-(1,3-benzoxazol-2-yl)-1-N-benzylbenzene-1,2-diamine
Names & synonyms
SCHEMBL2688591IQFGFKHRQWQPAK-UHFFFAOYSA-N2-(2-benzylaminoanilin-5-yl)benzoxazole
Database identifiers
- PubChem CID
- 67498804
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 64.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 398
Related reactions
2 records
Compound notes
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