Basic information
- CAS
27060-91-9- Standard SMILES
O=C1CN2CCOC2(c2ccccc2F)c2cc(Cl)ccc2N1CCO- InChIKey
WMFSSTNVXWNLKI-UHFFFAOYSA-N- Molecular formula
- C19H18ClFN2O3
- Average molar mass
- 376.8 g/mol
- Monoisotopic mass
- 376.0989983
Overview
Flutazolam is a hemiaminal ether and an organic molecular entity.
Names & identifiers
- Preferred name
- Flutazolam
- IUPAC
- 10-chloro-11b-(2-fluorophenyl)-7-(2-hydroxyethyl)-3,5-dihydro-2H-[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6-one
- English name
- Flutazolam
- Molecular formula
- C19H18ClFN2O3
- Molecular weight
- 376.81
Names & synonyms
flutazolam27060-91-9CoreminalFlutazolamum5G2K7O5D8SDTXSID602307210-Chloro-11b-(2-fluorophenyl)-2,3,7,11b-tetrahydro-7-(2-hydroxyethyl)oxazolo(3,2-d)(1,4)benzodiazepin-6(5H)-oneRefChem:921729DTXCID20307210-chloro-11b-(2'-fluorophenyl)-2,3,5,6,7,11b-hexahydro-7-(2''-hydroxyethyl)benzo(6,7)-1,4-diazepino(5,4-b)oxazol-6-one10-chloro-11b-(2-fluorophenyl)-7-(2-hydroxyethyl)-3,5-dihydro-2H-[1,3]oxazolo[3,2-d][1,4]benzodiazepin-6-one10-Chloro-11b-(o-fluorophenyl)-2,3,7,11b-tetrahydro-7-(2-hydroxyethyl)oxazolo(3,2-d)(1,4)benzodiazepin-6(5H)-one
Show more names
MS-4104MS 4101Ro 7-610210-Chloro-11b-(o-fluorophenyl)-2,3,7,11b-tetrahydro-7-(2-hydroxyethyl)oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one10-Chloro-11b-(2-fluorophenyl)-2,3,7,11b-tetrahydro-7-(2-hydroxyethyl)oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-oneOxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one, 10-chloro-11b-(2-fluorophenyl)-2,3,7,11b-tetrahydro-7-(2-hydroxyethyl)-Oxazolo[3,2-d][1,4]benzodiazepin-6(5H)-one, 10-chloro-11b-(o-fluorophenyl)-2,3,7,11b-tetrahydro-7-(2-hydroxyethyl)- (8CI)
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 53 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 539
Experimental & physicochemical properties
DrugsPharmaceuticals -> Nervous system -> Anxiolytics
Physicochemical properties
- Melting point
- 142 · 142-147°
- Boiling point
- 601.9 · 601.9±55.0 °C(Predicted)
- Density
- 1.297 · 1.2970 (estimate)
- solubility
- DMSO (Slightly), Methanol (Slightly, Sonicated)
- form
- Solid
- pka
- 5.4 · 5.40(at 25℃)
- color
- White to Pale Yellow
- FDA UNII
- 5 G2K7O5D8S · 5G2K7O5D8S
Chemistry & industry
Applications
DescriptionFlutazolam is a benzodiazepine anxiolytic closely related to mexazolam. It is useful in the treatment of anxiety, stress and depression in hypersensitive colon syndrome, chronic gastritis, and gastric and duodenal ulcers.
UsesFlutazolam can be used as analyte in analytical study of development and application of a multi-component LC-MS/MS method for determination of designer benzodiazepines in urine. A benzodiazepine derivative that has sedative, muscle relaxant, anticonvulsant, and anxiolytic effects.
Suppliers5 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
Henan Bao Enluo International TradeCo.，LTD+86-17331933971 · [email protected]
Xiamen Wonderful Bio Technology Co., Ltd.+86-13043004613 · [email protected]
Wuhan Han Sheng New Material Technology Co.，Ltd+86-17798174412 · [email protected]
Additional notes
DefinitionChEBI: Flutazolam is an organic molecular entity and a hemiaminal ether.
Related reactions
14 records
Compound notes
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