Basic information
- CAS
52042-01-0- Standard SMILES
CCS(=O)(=O)CCN1C(=O)CN=C(c2ccccc2F)c2cc(Cl)ccc21- InChIKey
BSPSXMXQKZZNFP-UHFFFAOYSA-N- Molecular formula
- C19H18ClFN2O3S
- Average molar mass
- 408.9 g/mol
- Monoisotopic mass
- 408.0710695
Overview
Elfazepam is a small molecule drug. The usage of the INN stem '-azepam' in the name indicates that Elfazepam is a diazepam derivative. Elfazepam has a monoisotopic molecular weight of 408.07 Da.
Names & identifiers
- Preferred name
- Elfazepam
- IUPAC
- 7-chloro-1-(2-ethylsulfonylethyl)-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one
- English name
- Elfazepam
- Molecular formula
- C19H18ClFN2O3S
- Molecular weight
- 408.87
Names & synonyms
Elfazepam52042-01-0SK&F 72517ElfazepamumRM53R5R2BLNSC-297938SK&F-72517DTXSID002000087-Chloro-1-(2-(ethylsulfonyl)ethyl)-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazep in-2-oneRefChem:920892DTXCID601224997-chloro-1-(2-ethylsulfonylethyl)-5-(2-fluorophenyl)-3H-1,4-benzodiazepin-2-one
Show more names
7-Chloro-1-[2-(ethylsulfonyl)ethyl]-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-one2H-1,4-Benzodiazepin-2-one, 7-chloro-1-[2-(ethylsulfonyl)ethyl]-5-(2-fluorophenyl)-1,3-dihydro-
NSC2979387-Chloro-1-(2-(ethylsulfonyl)ethyl)-5-(o-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepin-2-oneUNII-RM53R5R2BL2H-1,4-Benzodiazepin-2-one, 7-chloro-1-(2-(ethylsulfonyl)ethyl)-5-(2-fluorophenyl)-1,3-dihydro-Elfazepam [USAN:INN]Elfazepamum [INN-Latin]NSC 297938ELFAZEPAM [INN]
Database identifiers
- CAS
52042-01-0- PubChem CID
- 65445
- DTXSID
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 75.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 679
Physicochemical properties
- Boiling point
- 666.4 · 666.4±55.0 °C(Predicted)
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- pka
- 1.47 · 1.47±0.35(Predicted)
- FDA UNII
- 53 R5R2BL · RM53R5R2BL
Chemistry & industry
Applications
UsesAppetite stimulant (veterinary.
Suppliers2 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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