1H-Pyrazino(3,2,1-jk)(1,4)benzodiazepine-2,3-dione, 5,6,7,8-tetrahydro-6-methyl-7-propyl-
Basic information
- CAS
136723-00-7- Standard SMILES
CCCN1Cc2cccc3[nH]c(=O)c(=O)n(c23)CC1C- InChIKey
CCIDXHRGBIOSBB-UHFFFAOYSA-N- Molecular formula
- C15H19N3O2
- Average molar mass
- 273.33 g/mol
- Monoisotopic mass
- 273.14772686
Names & identifiers
- Preferred name
- 1H-Pyrazino(3,2,1-jk)(1,4)benzodiazepine-2,3-dione, 5,6,7,8-tetrahydro-6-methyl-7-propyl-
- IUPAC
- 12-methyl-11-propyl-1,4,11-triazatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene-2,3-dione
Names & synonyms
136723-00-71H-Pyrazino(3,2,1-jk)(1,4)benzodiazepine-2,3-dione, 5,6,7,8-tetrahydro-6-methyl-7-propyl-1H-Pyrazino[3,2,1-jk][1,4]benzodiazepine-2,3-dione, 5,6,7,8-tetrahydro-6-methyl-7-propyl-CHEMBL108382DTXSID409295246-Methyl-7-propyl-5,6,7,8-tetrahydro-1H-[1,4]diazepino[1,7,6-de]quinoxaline-2,3-dione
Database identifiers
- CAS
136723-00-7- PubChem CID
- 453601
- DTXSID
DTXSID40929524- ChEMBL
CHEMBL108382
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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