1-(2-Chlorophenyl)-3-hexadecylurea
Basic information
- CAS
6312-78-3- Standard SMILES
CCCCCCCCCCCCCCCCNC(=O)Nc1ccccc1Cl- InChIKey
SFZIOBCLKQZUJR-UHFFFAOYSA-N- Molecular formula
- C23H39ClN2O
- Average molar mass
- 395 g/mol
- Monoisotopic mass
- 394.2750916
Names & identifiers
- Preferred name
- 1-(2-Chlorophenyl)-3-hexadecylurea
- IUPAC
- 1-(2-chlorophenyl)-3-hexadecylurea
Names & synonyms
6312-78-31-(2-chlorophenyl)-3-hexadecylureaNSC40505DTXSID50285108NSC-40505N-(2-Chlorophenyl)-N'-hexadecylurea
Database identifiers
- CAS
6312-78-3- PubChem CID
- 237200
- DTXSID
DTXSID50285108
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 16
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 351
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Compound notes
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