N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methoxy-2-methylquinolin-4-amine
Basic information
- CAS
91919-67-4- Standard SMILES
COc1ccc2nc(C)cc(NN=Cc3ccc(N(CCCl)CCCl)cc3)c2c1- InChIKey
ZPHXBNLMXZOOHV-UHFFFAOYSA-N- Molecular formula
- C22H24Cl2N4O
- Average molar mass
- 431.4 g/mol
- Monoisotopic mass
- 430.1327168
Names & identifiers
- Preferred name
- N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methoxy-2-methylquinolin-4-amine
- IUPAC
- N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methoxy-2-methylquinolin-4-amine
Names & synonyms
91919-67-4N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-6-methoxy-2-methylquinolin-4-amineDTXSID10317272N,N-Bis(2-chloroethyl)-4-{[2-(6-methoxy-2-methylquinolin-4-yl)hydrazinylidene]methyl}aniline
Database identifiers
- CAS
91919-67-4- PubChem CID
- 329660
- DTXSID
DTXSID10317272
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 495
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Compound notes
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