Basic information
- CAS
89331-39-5- Standard SMILES
CN(C)N=Nc1ccc(C(=O)NC(Cc2ccccc2)C(=O)O)cc1- InChIKey
RRZYNIPFPRIUHP-UHFFFAOYSA-N- Molecular formula
- C18H20N4O3
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.15354051
Names & identifiers
- Preferred name
- N-(p-(3,3-Dimethyl-1-triazeno)benzoyl)-3-phenylalanine
- IUPAC
- 2-[[4-(dimethylaminodiazenyl)benzoyl]amino]-3-phenylpropanoic acid
Names & synonyms
89331-39-5BRN 5115619N-(p-(3,3-Dimethyl-1-triazeno)benzoyl)-3-phenylalanineNSC351611Alanine, N-(p-(3,3-dimethyl-1-triazeno)benzoyl)-3-phenyl-L-Phenylalanine, N-(4-(3,3-dimethyl-1-triazenyl)benzoyl)-N-p-((3,3-Dimethyl-1-triazeno)benzoyl)phenylalanin [German]N-p-((Dimethyl-3,3 triazeno-1) benzoyl) phenylalanine [French]N-p-((3,3-Dimethyl-1-triazeno)benzoyl)phenylalaninN-p-((Dimethyl-3,3 triazeno-1) benzoyl) phenylalanineNSC 351611NSC-351611
Database identifiers
- CAS
89331-39-5- PubChem CID
- 100166
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 94.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 467
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…