Clobetasone butyrateProduct ingredient for Clobetasone
- Name
- Clobetasone butyrate
- Drug Entry
- Clobetasone
Clobetasone is a corticosteroid that is often employed topically as a treatment for a variety of conditions such as eczema, psoriasis, various forms of dermatitis, and also for certain ophthalmologic conditions. Topical clobetasone butyrate has shown minimal suppression of the Hypothalamic-pituitary-adrenal axis.
- Accession Number
- DBSALT001967
- Structure
Structure for Clobetasone butyrate (DBSALT001967)
- Synonyms
- Clobetasone 17-butyrate
- External IDs
- CCI 5537 / CCI-5537 / GR 2/1214
- UNII
- 8U0H6XI6EO
- CAS Number
- 25122-57-0
- Weight
- Average: 478.99
Monoisotopic: 478.19223 - Chemical Formula
- C26H32ClFO5
- InChI Key
- FBRAWBYQGRLCEK-AVVSTMBFSA-N
- InChI
- InChI=1S/C26H32ClFO5/c1-5-6-22(32)33-26(21(31)14-27)15(2)11-19-18-8-7-16-12-17(29)9-10-23(16,3)25(18,28)20(30)13-24(19,26)4/h9-10,12,15,18-19H,5-8,11,13-14H2,1-4H3/t15-,18-,19-,23-,24-,25-,26-/m0/s1
- IUPAC Name
- (1R,2S,10S,11S,13S,14R,15S)-14-(2-chloroacetyl)-1-fluoro-2,13,15-trimethyl-5,17-dioxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-14-yl butanoate
- SMILES
- [H][C@]1(C)C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@]2(C)[C@@]1(OC(=O)CCC)C(=O)CCl
- External Links
- ChemSpider
- 64481
- ChEBI
- 31415
- ChEMBL
- CHEMBL577673
- ZINC
- ZINC000004215391
- Wikipedia
- Clobetasone_butyrate
- Predicted Properties
Property Value Source Water Solubility 0.00174 mg/mL ALOGPS logP 3.77 ALOGPS logP 5.19 Chemaxon logS -5.4 ALOGPS pKa (Strongest Acidic) 15.09 Chemaxon pKa (Strongest Basic) -5.6 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 4 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 77.51 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 123.1 m3·mol-1 Chemaxon Polarizability 49.52 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon