Basic information
- CAS
19888-56-3- Standard SMILES
CC(=O)OCC(=O)[C@@]12N=C(C)O[C@@H]1C[C@H]1[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C- InChIKey
BYZCJOHDXLROEC-RBWIMXSLSA-N- Molecular formula
- C25H30FNO6
- Average molar mass
- 459.5 g/mol
- Monoisotopic mass
- 459.20571584
Overview
Fluazacort is a corticosteroid hormone.
Names & identifiers
- Preferred name
- Fluazacort
- IUPAC
- [2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,14,17-trien-8-yl]-2-oxoethyl] acetate
- English name
- fluazacort
- Molecular formula
- C25H30FNO6
- Molecular weight
- 459.51
Names & synonyms
FLUAZACORT19888-56-3FluazacortumL-6400Y37GZ3VFSS5'H-Pregna-1,4-dieno(17,16-d)oxazole-3,20-dione, 21-(acetyloxy)-9-fluoro-11-hydroxy-2'-methyl-, (5'beta,11beta)-9 alpha-fluoro-11 beta,21-dihydroxy-3,20-dioxo-1,4-pregnadieno(17 alpha,16 alpha-d)-2-methyloxazoline 21-acetateDTXSID001043205RefChem:921676DTXCID80813377243-400-25'H-pregna-1,4-dieno(17,16-d)oxazole-3,20-dione, 21-(acetyloxy)-9-fluoro-11-hydroxy-2'-methyl-, (11 beta,16 beta)-
Show more names
21-acetoxy-9-fluoro-11β-hydroxy-2'-methyl-(16β)-pregna-1,4-dieno[17,16-d]oxazole-3,20-dione9α-Fluoro-11β,21-dihydroxy-3,20-dioxo-1,4-pregnadieno[17α,16α-d]-2-Methyloxazoline 21-Acetate(16β)-21-(Acetoxy)-9-fluoro-11β-hydroxy-2'-methylpregnano[17,16-d]oxazole-1,4-diene-3,20-dione(5'β)-9-Fluoro-11β,21-dihydroxy-2'-methylpregnano[17,16-d]oxazole-1,4-diene-3,20-dione 21-acetate(11β,16β)-21-(Acetyloxy)-9-fluoro-11-hydroxy-2'-Methyl-5'H-pregna-1,4-dieno[17,16-d]oxazole-3,20-dione
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 1,050
Experimental & physicochemical properties
DrugsPharmaceuticals -> Dermatologicals -> Corticosteroids, dermatological preparations
Physicochemical properties
- Melting point
- 252 · 252-255°
- alpha
- 54.8 ° · D +54.8° (c = 0.5 in CHCl3)
- Boiling point
- 592.379 · 592.379±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.437 · 1.437±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.138 · 13.138±0.70(predicted)
- FDA UNII
- 37 GZ3VFSS · Y37GZ3VFSS
Chemistry & industry
Applications
Usesfluazacort is a glucucorticoid with anti-inflammatory properties used in the treatment of skin diseases.
Upstream & downstream products
Upstream raw materials
Suppliers8 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
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No reaction records under the current filter.
Compound notes
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