Basic information
- CAS
38915-37-6- Standard SMILES
CCCCOc1ccc2nc3cc(Cl)ccc3c(NCCNCCCl)c2n1.Cl.Cl- InChIKey
RZKIIOJKDLKOTH-UHFFFAOYSA-N- Molecular formula
- C20H26Cl4N4O
- Average molar mass
- 480.3 g/mol
- Monoisotopic mass
- 478.086072
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N'-(2-chloroethyl)-, dihydrochloride
- IUPAC
- N'-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-N-(2-chloroethyl)ethane-1,2-diamine;dihydrochloride
Names & synonyms
ICR 4471,2-Ethanediamine, N-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N'-(2-chloroethyl)-, dihydrochloride38915-37-6DTXSID901921802-Butoxy-7-chloro-10-((2-((2-chloroethyl)amino)ethyl)amino)benzo(b)-1,5-naphthyridine 2HClRefChem:216282DTXCID00114671N~1~-(2-Butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-N~2~-(2-chloroethyl)ethane-1,2-diamine--hydrogen chloride (1/2)
Database identifiers
- CAS
38915-37-6- PubChem CID
- 217489
- DTXSID
DTXSID90192180
Properties
Computed structural properties
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 431
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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