Betamethasone dipropionateProduct ingredient for Betamethasone
- Name
- Betamethasone dipropionate
- Drug Entry
- Betamethasone
Betamethasone is a long-acting corticosteroid with immunosuppressive and antiinflammatory properties.11 It can be used topically to manage inflammatory skin conditions such as eczema, and parenterally to manage several disease states including autoimmune disorders.11 Betamethasone has potent glucocorticoid activity and negligible mineralocorticoid activity.11
- Accession Number
- DBSALT000851
- Structure
- Synonyms
- Not Available
- UNII
- 826Y60901U
- CAS Number
- 5593-20-4
- Weight
- Average: 504.595
Monoisotopic: 504.252331694 - Chemical Formula
- C28H37FO7
- InChI Key
- CIWBQSYVNNPZIQ-XYWKZLDCSA-N
- InChI
- InChI=1S/C28H37FO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1
- IUPAC Name
- 2-[(1R,2S,10S,11S,13S,14R,15S,17S)-1-fluoro-17-hydroxy-2,13,15-trimethyl-5-oxo-14-(propanoyloxy)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadeca-3,6-dien-14-yl]-2-oxoethyl propanoate
- SMILES
- [H][C@]1(C)C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@]([H])(O)C[C@]2(C)[C@@]1(OC(=O)CC)C(=O)COC(=O)CC
- External Links
- PubChem Compound
- 45356876
- ChemSpider
- 20490
- BindingDB
- 50421892
- ChEBI
- 31276
- ChEMBL
- CHEMBL1200384
- ZINC
- ZINC000004212137
- Wikipedia
- Betamethasone_dipropionate
- Predicted Properties
Property Value Source Water Solubility 0.00462 mg/mL ALOGPS logP 3.38 ALOGPS logP 3.96 Chemaxon logS -5 ALOGPS pKa (Strongest Acidic) 13.64 Chemaxon pKa (Strongest Basic) -3.4 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 106.97 Å2 Chemaxon Rotatable Bond Count 8 Chemaxon Refractivity 130.05 m3·mol-1 Chemaxon Polarizability 53.16 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon