N-[4-[(E)-(octadecylcarbamothioylhydrazinylidene)methyl]phenyl]acetamide
Basic information
- CAS
7148-66-5- Standard SMILES
CCCCCCCCCCCCCCCCCCNC(=S)N/N=C/c1ccc(NC(C)=O)cc1- InChIKey
TXEMUBJIUOFIGE-BGABXYSRSA-N- Molecular formula
- C28H48N4OS
- Average molar mass
- 488.8 g/mol
- Monoisotopic mass
- 488.35488334
Names & identifiers
- Preferred name
- N-[4-[(E)-(octadecylcarbamothioylhydrazinylidene)methyl]phenyl]acetamide
- IUPAC
- N-[4-[(E)-(octadecylcarbamothioylhydrazinylidene)methyl]phenyl]acetamide
Names & synonyms
NSC644047148-66-5DTXSID30430139NSC-64404N-(4-{(E)-[2-(Octadecylcarbamothioyl)hydrazinylidene]methyl}phenyl)acetamide
Database identifiers
- CAS
7148-66-5- PubChem CID
- 9561586
- DTXSID
DTXSID30430139
Properties
Computed structural properties
- XLogP
- 9.6
- Topological polar surface area
- 97.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 20
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 532
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Compound notes
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