Triamcinolone acetonide 21-dihydrogen phosphate
TL;DR: Triamcinolone acetonide 21-dihydrogen phosphate (CAS 989-96-8) is a chemical compound with molecular formula C24H32FO9P and molecular weight 514.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] dihydrogen phosphate
Also Known As: Triamcinolone acetonide phosphate, Triamcinolone Acetonide Phosphoric Acid, Triamcinolone acetonide 21-(dihydrogen phosphate), TRIAMCINOLONE ACETONIDE 21-PHOSPHATE, TRIAMCINOLONE ACETONIDE 21-DIHYDROGEN PHOSPHATE
| Molecular Formula | C24H32FO9P |
|---|---|
| Molecular Weight | 514.18 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 514.1768 |
| Heavy Atoms | 35 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 989-96-8 |
|---|---|
| SMILES | C[C@]12C[C@@H]([C@]3([C@H]([C@@H]1C[C@@H]4[C@]2(OC(O4)(C)C)C(=O)COP(=O)(O)O)CCC5=CC(=O)C=C[C@@]53C)F)O |
| InChIKey | NXLTXRVPGUCAHF-JNQJZLCISA-N |
Product Overview
Triamcinolone acetonide 21-dihydrogen phosphate (CAS 989-96-8), with molecular formula C24H32FO9P and molecular weight 514.18 g/mol. IUPAC: [2-[(1S,2S,4R,8S,9S,11S,12R,13S)-12-fluoro-11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] dihydrogen phosphate.
Chemical Property Profile of Triamcinolone acetonide 21-dihydrogen phosphate
Property Insights of Triamcinolone acetonide 21-dihydrogen phosphate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triamcinolone acetonide 21-dihydrogen phosphate. The TPSA of 140.0 Ų indicates high polarity, suggesting Triamcinolone acetonide 21-dihydrogen phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Triamcinolone acetonide 21-dihydrogen phosphate has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Triamcinolone acetonide 21-dihydrogen phosphate?
The CAS number of Triamcinolone acetonide 21-dihydrogen phosphate is 989-96-8.
What is the molecular formula of Triamcinolone acetonide 21-dihydrogen phosphate?
The molecular formula of Triamcinolone acetonide 21-dihydrogen phosphate is C24H32FO9P.
What is the molecular weight of Triamcinolone acetonide 21-dihydrogen phosphate?
The molecular weight of Triamcinolone acetonide 21-dihydrogen phosphate is 514.18 g/mol.
Where can I buy Triamcinolone acetonide 21-dihydrogen phosphate?
You can request a quote for Triamcinolone acetonide 21-dihydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triamcinolone acetonide 21-dihydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for Triamcinolone acetonide 21-dihydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.