1,3-Dihexadecanoylamino-2-valproyl-propan-ol
TL;DR: 1,3-Dihexadecanoylamino-2-valproyl-propan-ol (CAS 138404-96-3) is a chemical compound with molecular formula C43H83NO4 and molecular weight 677.63 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-amino-19-hydroxy-18-(2-propylpentanoyl)pentatriacontane-16,20-dione
Also Known As: 1,3-Ddvpo, 1,3-Dihexadecanoylamino-2-valproyl-propan-ol, 17-amino-19-hydroxy-18-(2-propylpentanoyl)pentatriacontane-16,20-dione, 2,5-Pyrrolidinedione,1-[[[(3-phenoxyphenyl)methoxy]carbonyl]oxy], 2-Propyl-pentanoic acid 2-hexadecanoylamino-1-(hexadecanoylamino-methyl)-ethyl ester
| Molecular Formula | C43H83NO4 |
|---|---|
| Molecular Weight | 677.63 g/mol |
| LogP | 15.4 |
| Topological Polar Surface Area | 97.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 38 |
| Exact Mass | 677.6322 |
| Heavy Atoms | 48 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 138404-96-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)O)C(=O)C(CCC)CCC)N |
| InChIKey | FLOYXHUDUZHEDR-UHFFFAOYSA-N |
Product Overview
1,3-Dihexadecanoylamino-2-valproyl-propan-ol (CAS 138404-96-3), with molecular formula C43H83NO4 and molecular weight 677.63 g/mol. IUPAC: 17-amino-19-hydroxy-18-(2-propylpentanoyl)pentatriacontane-16,20-dione.
Chemical Property Profile of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol
Property Insights of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol
The XLogP value of 15.4 indicates that 1,3-Dihexadecanoylamino-2-valproyl-propan-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dihexadecanoylamino-2-valproyl-propan-ol. Following Lipinski's Rule of Five, 1,3-Dihexadecanoylamino-2-valproyl-propan-ol has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol?
The CAS number of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol is 138404-96-3.
What is the molecular formula of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol?
The molecular formula of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol is C43H83NO4.
What is the molecular weight of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol?
The molecular weight of 1,3-Dihexadecanoylamino-2-valproyl-propan-ol is 677.63 g/mol.
Where can I buy 1,3-Dihexadecanoylamino-2-valproyl-propan-ol?
You can request a quote for 1,3-Dihexadecanoylamino-2-valproyl-propan-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dihexadecanoylamino-2-valproyl-propan-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dihexadecanoylamino-2-valproyl-propan-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.