Basic information
- Standard SMILES
CCCNc1ccc(N)cc1-c1nc2cc(-c3cc4ccccc4s3)ccc2o1- InChIKey
FCYWJFUZQBDVKG-UHFFFAOYSA-N- Molecular formula
- C24H21N3OS
- Average molar mass
- 399.5 g/mol
Names & identifiers
- Preferred name
- 2-(3-Amino-6-propylaminophenyl)-5-(2-benzothiophenyl)benzoxazole
- IUPAC
- 2-[5-(1-benzothiophen-2-yl)-1,3-benzoxazol-2-yl]-1-N-propylbenzene-1,4-diamine
Names & synonyms
SCHEMBL5834869FCYWJFUZQBDVKG-UHFFFAOYSA-N2-(3-Amino-6-propylaminophenyl)-5-(2-benzothiophenyl)benzoxazole
Database identifiers
- PubChem CID
- 21884299
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 548
Related reactions
2 records
Compound notes
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