RefChem:412723
TL;DR: RefChem:412723 (CAS 68959-31-9) is a chemical compound with molecular formula C46H88N4O6 and molecular weight 792.67 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis(2-hydroxyethyl)-6,8-di(octadecanoyl)-1,3,6,8-tetrazecane-2,7-dione
Also Known As: 1,3,6,8-Tetrazecine-2,7-dione, octahydro-1,3-bis(2-hydroxyethyl)-6,8-bis(1-oxooctadecyl)-, 1,3-bis(2-hydroxyethyl)-6,8-distearoyl-1,3,6,8-tetrazecane-2,7-dione, Octahydro-1,3-bis(2-hydroxyethyl)-6,8-distearoyl-1,3,6,8-tetrazecine-2,7-dione, 1,3-BIS(2-HYDROXYETHYL)-6,8-DIOCTADECANOYL-1,3,6,8-TETRAZECANE-2,7-DIONE, 1,3,6,8-Tetrazecine-2,7-dione,octahydro-1,3-bis(2-hydroxyethyl)-6,8-bis(1-oxooctadecyl)-
| Molecular Formula | C46H88N4O6 |
|---|---|
| Molecular Weight | 792.67 g/mol |
| LogP | 14.0 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 36 |
| Exact Mass | 792.6704 |
| Heavy Atoms | 56 |
| Complexity | 909.0 |
Chemical Identifiers
| CAS Number | 68959-31-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)N1CCN(C(=O)N(CCN(C1=O)C(=O)CCCCCCCCCCCCCCCCC)CCO)CCO |
| InChIKey | GWDOXPUQJKXPGI-UHFFFAOYSA-N |
Product Overview
RefChem:412723 (CAS 68959-31-9), with molecular formula C46H88N4O6 and molecular weight 792.67 g/mol. IUPAC: 1,3-bis(2-hydroxyethyl)-6,8-di(octadecanoyl)-1,3,6,8-tetrazecane-2,7-dione.
Chemical Property Profile of RefChem:412723
Property Insights of RefChem:412723
The XLogP value of 14.0 indicates that RefChem:412723 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:412723. Following Lipinski's Rule of Five, RefChem:412723 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:412723?
The CAS number of RefChem:412723 is 68959-31-9.
What is the molecular formula of RefChem:412723?
The molecular formula of RefChem:412723 is C46H88N4O6.
What is the molecular weight of RefChem:412723?
The molecular weight of RefChem:412723 is 792.67 g/mol.
Where can I buy RefChem:412723?
You can request a quote for RefChem:412723 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:412723?
Yes, KEHONG BIO provides custom synthesis services for RefChem:412723 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.