Basic information
- CAS
30146-50-0- Standard SMILES
CCN(CC)CCCC(C)Nc1nccc2nc(-c3ccc(Cl)cc3)cnc12- InChIKey
XLILXQJAMXUFRQ-UHFFFAOYSA-N- Molecular formula
- C22H28ClN5
- Average molar mass
- 397.9 g/mol
- Monoisotopic mass
- 397.2033236
Names & identifiers
- Preferred name
- n4-[2-(4-Chlorophenyl)pyrido[3,4-b]pyrazin-5-yl]-n1,n1-diethylpentane-1,4-diamine
- IUPAC
- 4-N-[2-(4-chlorophenyl)pyrido[3,4-b]pyrazin-5-yl]-1-N,1-N-diethylpentane-1,4-diamine
Names & synonyms
30146-50-0NSC131630n4-[2-(4-chlorophenyl)pyrido[3,4-b]pyrazin-5-yl]-n1,n1-diethylpentane-1,4-diamineDTXSID60299615XLILXQJAMXUFRQ-UHFFFAOYSA-NNSC-1316302-[p-Chlorophenyl]-5-[[4-[diethylamino]-1-methylbutyl]amino]pyrido[3,4]pyrazineN~4~-[2-(4-Chlorophenyl)pyrido[3,4-b]pyrazin-5-yl]-N~1~,N~1~-diethylpentane-1,4-diamine
Database identifiers
- CAS
30146-50-0- PubChem CID
- 280197
- DTXSID
DTXSID60299615
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 439
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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