Basic information
- CAS
34915-25-8- Standard SMILES
Nc1ccc(-c2ccc(N)c(CCCC(=O)O)c2)cc1CCCC(=O)O- InChIKey
WSOOIOONAKKNAU-UHFFFAOYSA-N- Molecular formula
- C20H24N2O4
- Average molar mass
- 356.4 g/mol
- Monoisotopic mass
- 356.17360725
Names & identifiers
- Preferred name
- 4-(2-Amino-5-(4-amino-3-(3-carboxypropyl)phenyl)phenyl)butanoic acid
- IUPAC
- 4-[2-amino-5-[4-amino-3-(3-carboxypropyl)phenyl]phenyl]butanoic acid
Names & synonyms
34915-25-84-(2-Amino-5-(4-amino-3-(3-carboxypropyl)phenyl)phenyl)butanoic acidSCHEMBL30118854DTXSID201884704,4'-(4,4'-Diamino[1,1'-biphenyl]-3,3'-diyl)dibutanoic acid
Database identifiers
- CAS
34915-25-8- PubChem CID
- 190342
- DTXSID
DTXSID20188470
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 429
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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