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Basic information
- Standard SMILES
CN1CCN(Cc2cc(Nc3ccnc4cc(Cl)ccc34)ccc2N2CCN(C)CC2)CC1- InChIKey
LXBXOJCOKJSFPN-UHFFFAOYSA-N- Molecular formula
- C26H33ClN6
- Average molar mass
- 465 g/mol
- Monoisotopic mass
- 464.2455228
Names & identifiers
- Preferred name
- 7-chloro-N-[4-(4-methylpiperazin-1-yl)-3-[(4-methylpiperazin-1-yl) methyl]phenyl]quinolin-4-amine
- IUPAC
- 7-chloro-N-[4-(4-methylpiperazin-1-yl)-3-[(4-methylpiperazin-1-yl)methyl]phenyl]quinolin-4-amine
Names & synonyms
SCHEMBL2053872LXBXOJCOKJSFPN-UHFFFAOYSA-N7-chloro-N-[4-(4-methylpiperazin-1-yl)-3-[(4-methylpiperazin-1-yl) methyl]phenyl]quinolin-4-amine
Database identifiers
- PubChem CID
- 67262011
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 37.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 606
Related reactions
1 records
Compound notes
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