Maxacalcitol
TL;DR: Maxacalcitol (CAS 132071-85-3) is a chemical compound with molecular formula C26H42O4 and molecular weight 418.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-1-[(1S)-1-(3-hydroxy-3-methylbutoxy)ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Also Known As: Maxacalcitol, 22-Oxacalcitriol, Prezios, Oxarol, maxacalcitriol
| Molecular Formula | C26H42O4 |
|---|---|
| Molecular Weight | 418.31 g/mol |
| LogP | 4.6935 |
| Topological Polar Surface Area | 69.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.30832 |
| Heavy Atoms | 30 |
| Complexity | 685.6374 |
Chemical Identifiers
| CAS Number | 132071-85-3 |
|---|---|
| SMILES | C[C@@H]([C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C)OCCC(C)(C)O |
Product Overview
Maxacalcitol (CAS 132071-85-3), with molecular formula C26H42O4 and molecular weight 418.31 g/mol. IUPAC: trans-(1R,3S,5Z)-5-[(2E)-2-[(1S,3aS,7aS)-1-[(1S)-1-(3-hydroxy-3-methylbutoxy)ethyl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol.
Chemical Property Profile of Maxacalcitol
Property Insights of Maxacalcitol
The XLogP value of 4.6935 indicates that Maxacalcitol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Maxacalcitol. Following Lipinski's Rule of Five, Maxacalcitol has 3 hydrogen bond donor(s) and 4 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 Maxacalcitol?
The CAS number of Maxacalcitol is 132071-85-3.
What is the molecular formula of Maxacalcitol?
The molecular formula of Maxacalcitol is C26H42O4.
What is the molecular weight of Maxacalcitol?
The molecular weight of Maxacalcitol is 418.31 g/mol.
Where can I buy Maxacalcitol?
You can request a quote for Maxacalcitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Maxacalcitol?
Yes, KEHONG BIO provides custom synthesis services for Maxacalcitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.