Flumethasone pivalateProduct ingredient for Flumethasone
- Name
- Flumethasone pivalate
- Drug Entry
- Flumethasone
Flumethasone is a moderately potent difluorinated corticosteroid ester with anti-inflammatory, antipruritic and vasoconstrictive properties. As it is a privalate salt, its anti-inflammatory action is concentrated at the site of application. This local effect on diseased areas results in a prompt decrease in inflammation, exudation and itching.
- Accession Number
- DBSALT001004
- Structure
Structure for Flumethasone pivalate (DBSALT001004)
- Synonyms
- Flumetasone Pivalate
- UNII
- 0DV09X6F21
- CAS Number
- 2002-29-1
- Weight
- Average: 494.576
Monoisotopic: 494.247995205 - Chemical Formula
- C27H36F2O6
- InChI Key
- JWRMHDSINXPDHB-OJAGFMMFSA-N
- InChI
- InChI=1S/C27H36F2O6/c1-14-9-16-17-11-19(28)18-10-15(30)7-8-24(18,5)26(17,29)20(31)12-25(16,6)27(14,34)21(32)13-35-22(33)23(2,3)4/h7-8,10,14,16-17,19-20,31,34H,9,11-13H2,1-6H3/t14-,16+,17+,19+,20+,24+,25+,26+,27+/m1/s1
- IUPAC Name
- 2-[(1R,2S,8S,10S,11S,13R,14R,15S,17S)-1,8-difluoro-14,17-dihydroxy-2,13,15-trimethyl-5-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-14-yl]-2-oxoethyl 2,2-dimethylpropanoate
- SMILES
- [H][C@@]12C[C@@H](C)[C@](O)(C(=O)COC(=O)C(C)(C)C)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](F)C2=CC(=O)C=C[C@]12C
- External Links
- Human Metabolome Database
- HMDB0014801
- KEGG Drug
- D01464
- ChemSpider
- 392021
- ChEBI
- 31620
- ChEMBL
- CHEMBL1200877
- ZINC
- ZINC000003977985
- PharmGKB
- PA164749388
- Wikipedia
- Flumetasone
- Predicted Properties
Property Value Source Water Solubility 0.0107 mg/mL ALOGPS logP 3.21 ALOGPS logP 3.58 Chemaxon logS -4.7 ALOGPS pKa (Strongest Acidic) 12.44 Chemaxon pKa (Strongest Basic) -3.4 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 100.9 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 125.17 m3·mol-1 Chemaxon Polarizability 50.91 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon