Basic information
- CAS
38915-07-0- Standard SMILES
COc1ccc2nc3ccccc3c(NCCNCCCl)c2c1.Cl.Cl- InChIKey
CECCNQHSQWOYTQ-UHFFFAOYSA-N- Molecular formula
- C18H22Cl3N3O
- Average molar mass
- 402.7 g/mol
- Monoisotopic mass
- 401.082845
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N-(2-chloroethyl)-N'-(2-methoxy-9-acridinyl)-, dihydrochloride
- IUPAC
- N-(2-chloroethyl)-N'-(2-methoxyacridin-9-yl)ethane-1,2-diamine;dihydrochloride
- English name
- ICR-411
- Molecular formula
- C18H21Cl2N3O
- Molecular weight
- 366.29
Names & synonyms
ICR 4111,2-Ethanediamine, N-(2-chloroethyl)-N'-(2-methoxy-9-acridinyl)-, dihydrochloride38915-07-0DTXSID001921719-((2-((2-Chloroethyl)amino)ethyl)amino)-2-methoxyacridine dihydrochlorideAcridine, 9-((2-((2-chloroethyl)amino)ethyl)amino)-2-methoxy-, dihydrochlorideRefChem:216284DTXCID10114662N~1~-(2-Chloroethyl)-N~2~-(2-methoxyacridin-9-yl)ethane-1,2-diamine--hydrogen chloride (1/2)ICR-411
Database identifiers
- CAS
38915-07-0- PubChem CID
- 217465
- DTXSID
DTXSID00192171
Properties
Computed structural properties
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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