n1-Benzyl-n4-(7-chloroquinolin-4-yl)-n1-methylpentane-1,4-diamine
Basic information
- CAS
31510-56-2- Standard SMILES
CC(CCCN(C)Cc1ccccc1)Nc1ccnc2cc(Cl)ccc12- InChIKey
WWYGIZAIIQNKMF-UHFFFAOYSA-N- Molecular formula
- C22H26ClN3
- Average molar mass
- 367.9 g/mol
- Monoisotopic mass
- 367.1815255
Names & identifiers
- Preferred name
- n1-Benzyl-n4-(7-chloroquinolin-4-yl)-n1-methylpentane-1,4-diamine
- IUPAC
- 1-N-benzyl-4-N-(7-chloroquinolin-4-yl)-1-N-methylpentane-1,4-diamine
Names & synonyms
n1-benzyl-n4-(7-chloroquinolin-4-yl)-n1-methylpentane-1,4-diamine31510-56-2DTXSID80301446RefChem:365099DTXCID80252580NSC143511SCHEMBL12643222WWYGIZAIIQNKMF-UHFFFAOYSA-N1-N-benzyl-4-N-(7-chloroquinolin-4-yl)-1-N-methylpentane-1,4-diamineNSC-1435117-Chloro-4-[1-methyl-4-[N-methyl-N-benzylamino]butylamino]quinolineN~1~-Benzyl-N~4~-(7-chloroquinolin-4-yl)-N~1~-methylpentane-1,4-diamine
Database identifiers
- CAS
31510-56-2- PubChem CID
- 285871
- DTXSID
DTXSID80301446
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 28.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 399
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Compound notes
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