1,25-dihydroxy-21-nor-20-oxavitamin D3
TL;DR: 1,25-dihydroxy-21-nor-20-oxavitamin D3 (CAS 106315-28-0) is a chemical compound with molecular formula C25H40O4 and molecular weight 404.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trans-(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-1-(4-hydroxy-4-methylpentoxy)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
Also Known As: 1,25-Dihydroxy-21-nor-20-oxavitamin D3, 1,25-(OH)2-21-Nor-20-oxad3, 1alpha,25-Dihydroxy-21-nor-20-oxavitamin D3, (1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-1-(4-hydroxy-4-methylpentoxy)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol, 1,3-Cyclohexanediol, 4-methylene-5-((octahydro-1-((4-hydroxy-4-methylpentyl)oxy)-7a-methyl-4H-inden-4-ylidene)ethylidene)-, (1S-(1alpha,3abeta,4E(1S*,3R*,5Z),7aalpha))-
| Molecular Formula | C25H40O4 |
|---|---|
| Molecular Weight | 404.29 g/mol |
| LogP | 4.4475 |
| Topological Polar Surface Area | 69.92 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.29266 |
| Heavy Atoms | 29 |
| Complexity | 656.22473 |
Chemical Identifiers
| CAS Number | 106315-28-0 |
|---|---|
| SMILES | C[C@]12CCC/C(=C\C=C\3/C[C@H](C[C@@H](C3=C)O)O)/[C@@H]1CCC2OCCCC(C)(C)O |
Product Overview
1,25-dihydroxy-21-nor-20-oxavitamin D3 (CAS 106315-28-0), with molecular formula C25H40O4 and molecular weight 404.29 g/mol. IUPAC: trans-(1R,3S,5E)-5-[(2E)-2-[(3aS,7aS)-1-(4-hydroxy-4-methylpentoxy)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol.
Chemical Property Profile of 1,25-dihydroxy-21-nor-20-oxavitamin D3
Property Insights of 1,25-dihydroxy-21-nor-20-oxavitamin D3
The XLogP value of 4.4475 indicates that 1,25-dihydroxy-21-nor-20-oxavitamin D3 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 1,25-dihydroxy-21-nor-20-oxavitamin D3. Following Lipinski's Rule of Five, 1,25-dihydroxy-21-nor-20-oxavitamin D3 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 1,25-dihydroxy-21-nor-20-oxavitamin D3?
The CAS number of 1,25-dihydroxy-21-nor-20-oxavitamin D3 is 106315-28-0.
What is the molecular formula of 1,25-dihydroxy-21-nor-20-oxavitamin D3?
The molecular formula of 1,25-dihydroxy-21-nor-20-oxavitamin D3 is C25H40O4.
What is the molecular weight of 1,25-dihydroxy-21-nor-20-oxavitamin D3?
The molecular weight of 1,25-dihydroxy-21-nor-20-oxavitamin D3 is 404.29 g/mol.
Where can I buy 1,25-dihydroxy-21-nor-20-oxavitamin D3?
You can request a quote for 1,25-dihydroxy-21-nor-20-oxavitamin D3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,25-dihydroxy-21-nor-20-oxavitamin D3?
Yes, KEHONG BIO provides custom synthesis services for 1,25-dihydroxy-21-nor-20-oxavitamin D3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.