N,N-bis(2-chloroethyl)-4-[(4-pyridin-2-ylphenyl)iminomethyl]aniline
Basic information
- CAS
18471-81-3- Standard SMILES
ClCCN(CCCl)c1ccc(C=Nc2ccc(-c3ccccn3)cc2)cc1- InChIKey
UKWCDJMNJYYOKZ-UHFFFAOYSA-N- Molecular formula
- C22H21Cl2N3
- Average molar mass
- 398.3 g/mol
- Monoisotopic mass
- 397.1112531
Names & identifiers
- Preferred name
- N,N-bis(2-chloroethyl)-4-[(4-pyridin-2-ylphenyl)iminomethyl]aniline
- IUPAC
- N,N-bis(2-chloroethyl)-4-[(4-pyridin-2-ylphenyl)iminomethyl]aniline
Names & synonyms
NSC103333NSC-10333318471-81-3
Database identifiers
- CAS
18471-81-3- PubChem CID
- 266145
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 28.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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