Basic information
- CAS
5330-53-0- Standard SMILES
CCN(CC)CCCC(C)N=C(c1ccc(N(C)C)cc1)c1ccc(N(C)C)cc1.O=C(O)CC(O)(CC(=O)O)C(=O)O- InChIKey
WZKLQFUKSBFEDL-UHFFFAOYSA-N- Molecular formula
- C32H48N4O7
- Average molar mass
- 600.7 g/mol
- Monoisotopic mass
- 600.35229988
Names & identifiers
- Preferred name
- 4-[N-[5-(diethylamino)pentan-2-yl]-C-[4-(dimethylamino)phenyl]carbonimidoyl]-N,N-dimethylaniline;2-hydroxypropane-1,2,3-tricarboxylic acid
- IUPAC
- 4-[N-[5-(diethylamino)pentan-2-yl]-C-[4-(dimethylamino)phenyl]carbonimidoyl]-N,N-dimethylaniline;2-hydroxypropane-1,2,3-tricarboxylic acid
Names & synonyms
NSC24895330-53-0NSC-2489N4-[BIS[4-(DIMETHYLAMINO)PHENYL]METHYLENE]-N1,4-PENTANEDIAMINE, CITRATE
Database identifiers
- CAS
5330-53-0- PubChem CID
- 220157
Properties
Computed structural properties
- Topological polar surface area
- 154 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 16
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 679
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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