WARNING: This product is for research use only, not for human or veterinary use.
MedKoo CAT#: 576525
CAS#: 102904-11-0
Description: ICI-116258 is an anti-inflammatory prodrug.
MedKoo Cat#: 576525
Name: ICI-116258
CAS#: 102904-11-0
Chemical Formula: C27H35ClN2O6
Exact Mass: 518.2184
Molecular Weight: 519.03
Elemental Analysis: C, 62.48; H, 6.80; Cl, 6.83; N, 5.40; O, 18.49
This product is not in stock, which may be available by custom synthesis.
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Synonym: ICI 116258; ICI116258; ICI-116258
IUPAC/Chemical Name: Propanoic acid, 2,2-dimethyl-, 4-(2-((2-((4-chlorobenzoyl)amino)ethyl)amino)-1-hydroxyethyl)-1,2-phenylene ester
InChi Key: OCJAVPIJUPKLSM-UHFFFAOYSA-N
InChi Code: InChI=1S/C27H35ClN2O6/c1-26(2,3)24(33)35-21-12-9-18(15-22(21)36-25(34)27(4,5)6)20(31)16-29-13-14-30-23(32)17-7-10-19(28)11-8-17/h7-12,15,20,29,31H,13-14,16H2,1-6H3,(H,30,32)
SMILES Code: CC(C)(C)C(=O)Oc1ccc(cc1OC(=O)C(C)(C)C)C(O)CNCCNC(=O)c2ccc(Cl)cc2
Appearance: Solid powder
Purity: >98% (or refer to the Certificate of Analysis)
Shipping Condition: Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility: To be determined
Shelf Life: >2 years if stored properly
Drug Formulation: To be determined
Stock Solution Storage: 0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code: 2934.99.9001
The following data is based on the product molecular weight 519.03 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.
| Concentration / Solvent Volume / Mass | 1 mg | 5 mg | 10 mg |
|---|---|---|---|
| 1 mM | 1.15 mL | 5.76 mL | 11.51 mL |
| 5 mM | 0.23 mL | 1.15 mL | 2.3 mL |
| 10 mM | 0.12 mL | 0.58 mL | 1.15 mL |
| 50 mM | 0.02 mL | 0.12 mL | 0.23 mL |
1. Bilski AJ, Evans JR, Harrison MP, Jones G, Marten TR, Milburn GT, Thomson DS, White DF. Lipoidal anti-inflammatory prodrugs as local targeting agents. Biochem Soc Trans. 1986 Apr;14(2):388-91. doi: 10.1042/bst0140388. PMID: 3011550.
