3-Cyclohexylhexahydro-1H-pyridazino(1,2-a)(1,2,5)triazepine-1,5(2H)-dione
Basic information
- CAS
69405-16-9- Standard SMILES
O=C1CN(C2CCCCC2)CC(=O)N2CCCCN12- InChIKey
FRASCJCLWQAAEN-UHFFFAOYSA-N- Molecular formula
- C14H23N3O2
- Average molar mass
- 265.35 g/mol
- Monoisotopic mass
- 265.17902698
Names & identifiers
- Preferred name
- 3-Cyclohexylhexahydro-1H-pyridazino(1,2-a)(1,2,5)triazepine-1,5(2H)-dione
- IUPAC
- 3-cyclohexyl-2,4,7,8,9,10-hexahydropyridazino[1,2-a][1,2,5]triazepine-1,5-dione
Names & synonyms
69405-16-94AZG3VJR783-Cyclohexylhexahydro-1H-pyridazino(1,2-a)(1,2,5)triazepine-1,5(2H)-dioneNSC337242UNII-4AZG3VJR78NSC 337242NSC-3372423-Cyclohexylhexahydro-1H-pyridazino[1,2-a][1,2,5]triazepine-1,5(2H)-dione3-cyclohexyl-2,4,7,8,9,10-hexahydropyridazino[1,2-a][1,2,5]triazepine-1,5-dioneDTXSID002195341H-Pyridazino[1,2-a][1,2,5]triazepine-1,5(2H)-dione, 3-cyclohexylhexahydro-
Database identifiers
- CAS
69405-16-9- PubChem CID
- 333695
- DTXSID
DTXSID00219534- UNII
- 4AZG3VJR78
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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