7-Acetamidonitrazepam
Basic information
- CAS
4928-03-4- Standard SMILES
CC(=O)Nc1ccc2c(c1)C(c1ccccc1)=NCC(=O)N2- InChIKey
JHTJXLGLYZQIGI-UHFFFAOYSA-N- Molecular formula
- C17H15N3O2
- Average molar mass
- 293.32 g/mol
- Monoisotopic mass
- 293.11642673
Overview
7-Acetamidonitrazepam is a benzodiazepine.
Names & identifiers
- Preferred name
- 7-Acetamidonitrazepam
- IUPAC
- N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)acetamide
- English name
- Acetamide, N-(2,3-dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepin-7-yl)-
- Molecular formula
- C17H15N3O2
- Molecular weight
- 293.32
Names & synonyms
7-Acetamidonitrazepam4928-03-47-AcetylaminonitrazepamDGJ0AN44HYAcetamide, N-(2,3-dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepin-7-yl)-NSC-587772H-1,4-Benzodiazepin-2-one, 7-acetamido-1,3-dihydro-5-phenyl-Ro 05-3305J493.051GDTXSID30197750N-(2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)acetamideRefChem:105753
Show more names
1,3-Dihydro-7-acetaMido-5-phenyl-2H-1,4-benzodiazepin-2-oneN-(2,3-Dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepin-7-yl)acetaMide
DTXCID901202417-Acetamido NitrazepamN-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-7-yl)acetamideN-(2-Oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-7-yl)acetamideNSC 58777NSC587777-Acetamido Nitrazepam 1.0 mg/mL in MethanolUNII-DGJ0AN44HY
Database identifiers
- CAS
4928-03-4- PubChem CID
- 96190
- DTXSID
DTXSID30197750- ChEBI
CHEBI:166533- UNII
- DGJ0AN44HY
- Nikkaji
- J493.051G
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 70.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 469
Physicochemical properties
- Melting point
- 278 · 278-279 °C
- Boiling point
- 562.2 · 562.2±50.0 °C(Predicted)
- Density
- 1.28 · 1.28±0.1 g/cm3(Predicted)
- solubility
- DMSO (Slightly), Methanol (Slightly)
- pka
- 3.2 · pKa 3.2 12.4 (5%MeOH in H2O t=20 I=0.15) (Uncertain)
- form
- Solid
- color
- Pale Yellow to Yellow
- FDA UNII
- 0 AN44HY · DGJ0AN44HY
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationAcetamide, N-(2,3-dihydro-2-oxo-5-phenyl-1H-1,4-benzodiazepin-7-yl)-: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Applications
UsesA metabolite of Nitrazepam (N490140). Controlled substance (depressant).
Additional notes
DefinitionChEBI: 7-Acetamidonitrazepam is a benzodiazepine.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…