5-(N-Hexadecanoyl)aminoeosin
TL;DR: 5-(N-Hexadecanoyl)aminoeosin (CAS 114586-25-3) is a chemical compound with molecular formula C36H39Br4NO6 and molecular weight 896.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2',4',5',7'-tetrabromo-3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)hexadecanamide
Also Known As: 5-(N-Hexadecanoyl)aminoeosin, N-(2',4',5',7'-tetrabromo-3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)hexadecanamide, Hexadecanamide, N-(2',4',5',7'-tetrabromo-3',6'-dihydroxy-3-oxospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-5-yl)-, N-(2',4',5',7'-Tetrabromo-3',6'-dihydroxy-3-oxo-3H-spiro[[2]benzofuran-1,9'-xanthen]-5-yl)hexadecanamide, N-(2',4',5',7'-Tetrabromo-3',6'-dihydroxy-3-oxospiro(isobenzofuran-1(3H),9'-(9H)xanthen)-5-yl)hexadecanamide
| Molecular Formula | C36H39Br4NO6 |
|---|---|
| Molecular Weight | 896.95 g/mol |
| LogP | 12.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 896.9511 |
| Heavy Atoms | 47 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 114586-25-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)NC1=CC2=C(C=C1)C3(C4=CC(=C(C(=C4OC5=C(C(=C(C=C53)Br)O)Br)Br)O)Br)OC2=O |
| InChIKey | TVDLMLYZIDNGFM-UHFFFAOYSA-N |
Product Overview
5-(N-Hexadecanoyl)aminoeosin (CAS 114586-25-3), with molecular formula C36H39Br4NO6 and molecular weight 896.95 g/mol. IUPAC: N-(2',4',5',7'-tetrabromo-3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)hexadecanamide.
Chemical Property Profile of 5-(N-Hexadecanoyl)aminoeosin
Property Insights of 5-(N-Hexadecanoyl)aminoeosin
The XLogP value of 12.7 indicates that 5-(N-Hexadecanoyl)aminoeosin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(N-Hexadecanoyl)aminoeosin. Following Lipinski's Rule of Five, 5-(N-Hexadecanoyl)aminoeosin has 3 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 5-(N-Hexadecanoyl)aminoeosin?
The CAS number of 5-(N-Hexadecanoyl)aminoeosin is 114586-25-3.
What is the molecular formula of 5-(N-Hexadecanoyl)aminoeosin?
The molecular formula of 5-(N-Hexadecanoyl)aminoeosin is C36H39Br4NO6.
What is the molecular weight of 5-(N-Hexadecanoyl)aminoeosin?
The molecular weight of 5-(N-Hexadecanoyl)aminoeosin is 896.95 g/mol.
Where can I buy 5-(N-Hexadecanoyl)aminoeosin?
You can request a quote for 5-(N-Hexadecanoyl)aminoeosin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(N-Hexadecanoyl)aminoeosin?
Yes, KEHONG BIO provides custom synthesis services for 5-(N-Hexadecanoyl)aminoeosin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.