Methyl 2,5,6-tribenzamidohex-5-enoate
TL;DR: Methyl 2,5,6-tribenzamidohex-5-enoate (CAS 6284-29-3) is a chemical compound with molecular formula C28H27N3O5 and molecular weight 485.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,5,6-tribenzamidohex-5-enoate
Also Known As: methyl 2,5,6-tribenzamidohex-5-enoate, methyl (E)-2,5,6-tribenzamidohex-5-enoate, methyl 2,5,6-tris(benzoylamino)hex-5-enoate
| Molecular Formula | C28H27N3O5 |
|---|---|
| Molecular Weight | 485.20 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 485.19507 |
| Heavy Atoms | 36 |
| Complexity | 778.0 |
Chemical Identifiers
| CAS Number | 6284-29-3 |
|---|---|
| SMILES | COC(=O)C(CCC(=CNC(=O)C1=CC=CC=C1)NC(=O)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3 |
| InChIKey | BFKSJSYHMUSWFT-UHFFFAOYSA-N |
Product Overview
Methyl 2,5,6-tribenzamidohex-5-enoate (CAS 6284-29-3), with molecular formula C28H27N3O5 and molecular weight 485.20 g/mol. IUPAC: methyl 2,5,6-tribenzamidohex-5-enoate.
Chemical Property Profile of Methyl 2,5,6-tribenzamidohex-5-enoate
Property Insights of Methyl 2,5,6-tribenzamidohex-5-enoate
The XLogP value of 3.7 indicates that Methyl 2,5,6-tribenzamidohex-5-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2,5,6-tribenzamidohex-5-enoate. Following Lipinski's Rule of Five, Methyl 2,5,6-tribenzamidohex-5-enoate has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2,5,6-tribenzamidohex-5-enoate?
The CAS number of Methyl 2,5,6-tribenzamidohex-5-enoate is 6284-29-3.
What is the molecular formula of Methyl 2,5,6-tribenzamidohex-5-enoate?
The molecular formula of Methyl 2,5,6-tribenzamidohex-5-enoate is C28H27N3O5.
What is the molecular weight of Methyl 2,5,6-tribenzamidohex-5-enoate?
The molecular weight of Methyl 2,5,6-tribenzamidohex-5-enoate is 485.20 g/mol.
Where can I buy Methyl 2,5,6-tribenzamidohex-5-enoate?
You can request a quote for Methyl 2,5,6-tribenzamidohex-5-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,5,6-tribenzamidohex-5-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,5,6-tribenzamidohex-5-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.