Basic information
- CAS
38925-89-2- Standard SMILES
COc1ccc2nccc(NCCNCCCl)c2c1.Cl.Cl- InChIKey
QDFVQWOAZRXRKT-UHFFFAOYSA-N- Molecular formula
- C14H20Cl3N3O
- Average molar mass
- 352.7 g/mol
- Monoisotopic mass
- 351.067195
Names & identifiers
- Preferred name
- Icr 190
- IUPAC
- N-(2-chloroethyl)-N'-(6-methoxyquinolin-4-yl)ethane-1,2-diamine;dihydrochloride
- English name
- ICR-190
- Molecular formula
- C14H19Cl2N3O
- Molecular weight
- 316.23
Names & synonyms
ICR 19038925-89-2RefChem:1087150ICR-1904-((2-((2-Chloroethyl)amino)ethyl)amino)-6-methoxyquinoline dihydrochlorideDTXSID809597641,2-Ethanediamine, N-(2-chloroethyl)-N'-(6-methoxy-4-quinolinyl)-, dihydrochlorideQuinoline, 4-((2-((2-chloroethyl)amino)ethyl)amino)-6-methoxy-, dihydrochloride2-Chloro-N-{2-[(6-methoxyquinolin-4(1H)-ylidene)amino]ethyl}ethan-1-amine--hydrogen chloride (1/2)N-(2-chloroethyl)-N'-(6-methoxyquinolin-4-yl)ethane-1,2-diamine
Database identifiers
- CAS
38925-89-2- PubChem CID
- 217569
- DTXSID
DTXSID80959764
Properties
Computed structural properties
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 255
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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