Basic information
- Standard SMILES
CCCCCCCCc1ccc(N(C)C(=O)NCCC(=O)O)cc1- InChIKey
PBXXWWOHPBLQHG-UHFFFAOYSA-N- Molecular formula
- C19H30N2O3
- Average molar mass
- 334.5 g/mol
Names & identifiers
- Preferred name
- 3-(3-Methyl-3-(4-octylphenyl)ureido)propanoic acid
- IUPAC
- 3-[[methyl-(4-octylphenyl)carbamoyl]amino]propanoic acid
Names & synonyms
SCHEMBL177677PBXXWWOHPBLQHG-UHFFFAOYSA-N3-(3-Methyl-3-(4-octylphenyl)ureido)propanoic acid
Database identifiers
- PubChem CID
- 46199366
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 366
Related reactions
3 records
Compound notes
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