methylprednisolone phosphate
TL;DR: methylprednisolone phosphate (CAS 22252-38-6) is a chemical compound with molecular formula C22H31O8P and molecular weight 454.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] dihydrogen phosphate
Also Known As: methylprednisolone phosphate, Methylprednisolone Phosphoric Acid, methylprednisolone dihydrogen phosphate, Methylprednisolone 21-(dihydrogen phosphate), METHYLPREDNISOLONE 21-PHOSPHATE
| Molecular Formula | C22H31O8P |
|---|---|
| Molecular Weight | 454.18 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 454.17566 |
| Heavy Atoms | 31 |
| Complexity | 920.0 |
Chemical Identifiers
| CAS Number | 22252-38-6 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)COP(=O)(O)O)O |
| InChIKey | PWTIEVRZANUUHG-PJHHCJLFSA-N |
Product Overview
methylprednisolone phosphate (CAS 22252-38-6), with molecular formula C22H31O8P and molecular weight 454.18 g/mol. IUPAC: [2-[(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-6,10,13-trimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] dihydrogen phosphate.
Chemical Property Profile of methylprednisolone phosphate
Property Insights of methylprednisolone phosphate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methylprednisolone phosphate. The TPSA of 141.0 Ų indicates high polarity, suggesting methylprednisolone phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, methylprednisolone phosphate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methylprednisolone phosphate?
The CAS number of methylprednisolone phosphate is 22252-38-6.
What is the molecular formula of methylprednisolone phosphate?
The molecular formula of methylprednisolone phosphate is C22H31O8P.
What is the molecular weight of methylprednisolone phosphate?
The molecular weight of methylprednisolone phosphate is 454.18 g/mol.
Where can I buy methylprednisolone phosphate?
You can request a quote for methylprednisolone phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methylprednisolone phosphate?
Yes, KEHONG BIO provides custom synthesis services for methylprednisolone phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.