二乙基己基丁酰胺基三嗪酮
TL;DR: 二乙基己基丁酰胺基三嗪酮 (CAS 154702-15-5) is a chemical compound with molecular formula C44H59N7O5 and molecular weight 765.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二乙基己基丁酰胺基三嗪酮
2-ethylhexyl 4-[[4-[4-(tert-butylcarbamoyl)anilino]-6-[4-(2-ethylhexoxycarbonyl)anilino]-1,3,5-triazin-2-yl]amino]benzoate
Also Known As: ISCOTRIZINOL, Uvasorb HEB, DIETHYLHEXYL BUTAMIDO TRIAZONE, Iscotrizinol [USAN], INCI
| Molecular Formula | C44H59N7O5 |
|---|---|
| Molecular Weight | 765.46 g/mol |
| LogP | 10.3771 |
| Topological Polar Surface Area | 156.46 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 21 |
| Exact Mass | 765.45776 |
| Heavy Atoms | 56 |
| Complexity | 1746.2812 |
Chemical Identifiers
| CAS Number | 154702-15-5 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=N2)NC3=CC=C(C=C3)C(=O)NC(C)(C)C)NC4=CC=C(C=C4)C(=O)OCC(CC)CCCC |
Product Overview
二乙基己基丁酰胺基三嗪酮 (CAS 154702-15-5), with molecular formula C44H59N7O5 and molecular weight 765.46 g/mol. IUPAC: 2-ethylhexyl 4-[[4-[4-(tert-butylcarbamoyl)anilino]-6-[4-(2-ethylhexoxycarbonyl)anilino]-1,3,5-triazin-2-yl]amino]benzoate.
Chemical Property Profile of 二乙基己基丁酰胺基三嗪酮
Property Insights of 二乙基己基丁酰胺基三嗪酮
The XLogP value of 10.3771 indicates that 二乙基己基丁酰胺基三嗪酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.46 Ų indicates high polarity, suggesting 二乙基己基丁酰胺基三嗪酮 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 二乙基己基丁酰胺基三嗪酮 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 二乙基己基丁酰胺基三嗪酮?
The CAS number of 二乙基己基丁酰胺基三嗪酮 is 154702-15-5.
What is the molecular formula of 二乙基己基丁酰胺基三嗪酮?
The molecular formula of 二乙基己基丁酰胺基三嗪酮 is C44H59N7O5.
What is the molecular weight of 二乙基己基丁酰胺基三嗪酮?
The molecular weight of 二乙基己基丁酰胺基三嗪酮 is 765.46 g/mol.
Where can I buy 二乙基己基丁酰胺基三嗪酮?
You can request a quote for 二乙基己基丁酰胺基三嗪酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二乙基己基丁酰胺基三嗪酮?
Yes, KEHONG BIO provides custom synthesis services for 二乙基己基丁酰胺基三嗪酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.