1,2-Ethanediamine, N'-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N-(2-chloroethyl)-N-ethyl-, dihydrochloride
Basic information
- CAS
38915-39-8- Standard SMILES
CCCCOc1ccc2nc3cc(Cl)ccc3c(NCCN(CC)CCCl)c2n1.Cl.Cl- InChIKey
VGKQRVNLISWSCB-UHFFFAOYSA-N- Molecular formula
- C22H30Cl4N4O
- Average molar mass
- 508.3 g/mol
- Monoisotopic mass
- 506.117372
Names & identifiers
- Preferred name
- 1,2-Ethanediamine, N'-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N-(2-chloroethyl)-N-ethyl-, dihydrochloride
- IUPAC
- N-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-N'-(2-chloroethyl)-N'-ethylethane-1,2-diamine;dihydrochloride
Names & synonyms
ICR 3811,2-Ethanediamine, N'-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N-(2-chloroethyl)-N-ethyl-, dihydrochloride38915-39-8RefChem:216207DTXSID209597282-[(2-Butoxy-7-chlorobenzo[b][1,5]naphthyridin-10(5H)-ylidene)amino]-N-(2-chloroethyl)-N-ethylethan-1-amine--hydrogen chloride (1/2)
Database identifiers
- CAS
38915-39-8- PubChem CID
- 217491
- DTXSID
DTXSID20959728
Properties
Computed structural properties
- Topological polar surface area
- 50.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 472
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…