Acetamide, 2-(2-benzoxazolylthio)-N-[4-(2-phenyldiazenyl)phenyl]-
Basic information
- CAS
454689-99-7- Standard SMILES
O=C(CSc1nc2ccccc2o1)Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
BVNJCMRTMZRQSS-UHFFFAOYSA-N- Molecular formula
- C21H16N4O2S
- Average molar mass
- 388.4 g/mol
- Monoisotopic mass
- 388.09939694
Names & identifiers
- Preferred name
- Acetamide, 2-(2-benzoxazolylthio)-N-[4-(2-phenyldiazenyl)phenyl]-
- IUPAC
- 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(4-phenyldiazenylphenyl)acetamide
Names & synonyms
DTXSID201037826Acetamide, 2-(2-benzoxazolylthio)-N-[4-(2-phenyldiazenyl)phenyl]-AKOS030644032454689-99-7Z19652410
Database identifiers
- CAS
454689-99-7- PubChem CID
- 4166204
- DTXSID
DTXSID201037826
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 532
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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