TL;DR: Dexamethasone phenylpropionate (CAS 1879-72-7) is a chemical compound with molecular formula C31H37FO6 and molecular weight 524.25745 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 3-phenylpropanoate
Also Known As: Dexamethasone phenylpropionate, Dexamethasone 21-phenylpropionate, Dexamethasone 21-(3-phenylpropionate), Dexamethasone impurity 78, Dexafort [veterinary] (TN)
| Molecular Formula | C31H37FO6 |
| Molecular Weight | 524.25745 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 524.25745 Da |
| Heavy Atoms | 38 |
| Complexity | 1060.0 |
| SMILES | C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)COC(=O)CCC5=CC=CC=C5)O)C)O)F)C |
| InChIKey | CTKMBLPPDDQOSU-JPYVRCQISA-N |
The XLogP value of 4.5 indicates that Dexamethasone phenylpropionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dexamethasone phenylpropionate. Following Lipinski's Rule of Five, Dexamethasone phenylpropionate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dexamethasone phenylpropionate is 1879-72-7.
The molecular formula of Dexamethasone phenylpropionate is C31H37FO6.
The molecular weight of Dexamethasone phenylpropionate is 524.25745 g/mol.
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