Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCN(C(=O)OCc1ccccc1)c1ccc(C(=O)Cl)cc1- InChIKey
UXVNZBKRCCEIPX-UHFFFAOYSA-N- Molecular formula
- C31H44ClNO3
- Average molar mass
- 514.1 g/mol
Names & identifiers
- Preferred name
- N-carbobenzyloxy-4-(hexadecylamino)benzoyl chloride
- IUPAC
- benzyl N-(4-carbonochloridoylphenyl)-N-hexadecylcarbamate
Names & synonyms
SCHEMBL11070772UXVNZBKRCCEIPX-UHFFFAOYSA-NN-carbobenzyloxy-4-(hexadecylamino)benzoyl chloride
Database identifiers
- PubChem CID
- 20437379
Properties
Computed structural properties
- XLogP
- 11.4
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 20
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 570
Related reactions
9 records
Compound notes
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