19-Nor-10-ketovitamin D3
TL;DR: 19-Nor-10-ketovitamin D3 (CAS 62743-72-0) is a chemical compound with molecular formula C26H42O2 and molecular weight 386.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-hydroxycyclohexan-1-one
Also Known As: 19-Nor-10-ketovitamin D3, 19-NK-VD3, 5(E)-19-Nor-10-ketocholecalciferol, 2-[2-[7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-hydroxycyclohexan-1-one, 1-hydroxy-17-(6-methylheptan-2-yl)-9,10-secoestra-5,7-dien-4-one
| Molecular Formula | C26H42O2 |
|---|---|
| Molecular Weight | 386.32 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.31848 |
| Heavy Atoms | 28 |
| Complexity | 614.0 |
Chemical Identifiers
| CAS Number | 62743-72-0 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=O)O)C |
| InChIKey | GBQBUXZDVCNURD-UHFFFAOYSA-N |
Product Overview
19-Nor-10-ketovitamin D3 (CAS 62743-72-0), with molecular formula C26H42O2 and molecular weight 386.32 g/mol. IUPAC: 2-[2-[7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-hydroxycyclohexan-1-one.
Chemical Property Profile of 19-Nor-10-ketovitamin D3
Property Insights of 19-Nor-10-ketovitamin D3
The XLogP value of 7.2 indicates that 19-Nor-10-ketovitamin D3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 19-Nor-10-ketovitamin D3 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 19-Nor-10-ketovitamin D3 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 19-Nor-10-ketovitamin D3?
The CAS number of 19-Nor-10-ketovitamin D3 is 62743-72-0.
What is the molecular formula of 19-Nor-10-ketovitamin D3?
The molecular formula of 19-Nor-10-ketovitamin D3 is C26H42O2.
What is the molecular weight of 19-Nor-10-ketovitamin D3?
The molecular weight of 19-Nor-10-ketovitamin D3 is 386.32 g/mol.
Where can I buy 19-Nor-10-ketovitamin D3?
You can request a quote for 19-Nor-10-ketovitamin D3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 19-Nor-10-ketovitamin D3?
Yes, KEHONG BIO provides custom synthesis services for 19-Nor-10-ketovitamin D3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.