Basic information
- CAS
89990-58-9- Standard SMILES
CCN(CC)CCCN1CC(=O)N2CCCCN2C(=O)C1- InChIKey
GHCJCMPOUJQGRM-UHFFFAOYSA-N- Molecular formula
- C15H28N4O2
- Average molar mass
- 296.41 g/mol
- Monoisotopic mass
- 296.22122615
Names & identifiers
- Preferred name
- 3-(3-(Diethylamino)propyl)hexahydro-1H-pyridazino(1,2-a)(1,2,5)triazepine-1,5(2H)-dione
- IUPAC
- 3-[3-(diethylamino)propyl]-2,4,7,8,9,10-hexahydropyridazino[1,2-a][1,2,5]triazepine-1,5-dione
Names & synonyms
89990-58-9NQ9XDY4COYUNII-NQ9XDY4COY3-(3-(Diethylamino)propyl)hexahydro-1H-pyridazino(1,2-a)(1,2,5)triazepine-1,5(2H)-dione3-(3-(Diethylamino)propyl)hexahydro-1H-pyridazino[1,2-a][1,2,5]triazepine-1,5(2H)-dioneNSC 340315NSC-340315DTXSID902379691H-PYRIDAZINO(1,2-A)(1,2,5)TRIAZEPINE-1,5(2H)-DIONE, 3-(3-(DIETHYLAMINO)PROPYL)HEXAHYDRO-3-[3-(Diethylamino)propyl]hexahydro-1H-pyridazino[1,2-a][1,2,5]triazepine-1,5(2H)-dioneRefChem:92283DTXCID90160460
Show more names
NSC3403153-[3-(diethylamino)propyl]-2,4,7,8,9,10-hexahydropyridazino[1,2-a][1,2,5]triazepine-1,5-dioneDS-0050464-(3-Diethylaminopropyl)-1,4,7-triazabicyclo[5.4.0]undecane-2,6-dione
Database identifiers
- CAS
89990-58-9- PubChem CID
- 334615
- DTXSID
DTXSID90237969- UNII
- NQ9XDY4COY
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 47.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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