Benzeneacetamide, N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-
Basic information
- CAS
875194-03-9- Standard SMILES
O=C(Cc1ccccc1)NC(=S)Nc1ccc(N=Nc2ccccc2)cc1- InChIKey
SRDYMZAEQIKHQI-UHFFFAOYSA-N- Molecular formula
- C21H18N4OS
- Average molar mass
- 374.5 g/mol
- Monoisotopic mass
- 374.12013238
Names & identifiers
- Preferred name
- Benzeneacetamide, N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-
- IUPAC
- 2-phenyl-N-[(4-phenyldiazenylphenyl)carbamothioyl]acetamide
Names & synonyms
DTXSID401040396AKOS003448861Benzeneacetamide, N-[[[4-(2-phenyldiazenyl)phenyl]amino]thioxomethyl]-875194-03-9
Database identifiers
- CAS
875194-03-9- PubChem CID
- 4939734
- DTXSID
DTXSID401040396
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 504
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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