Em 800
TL;DR: Em 800 (CAS 182167-03-9) is a chemical compound with molecular formula C39H47NO6 and molecular weight 625.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(2S)-7-(2,2-dimethylpropanoyloxy)-4-methyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-3-yl]phenyl] 2,2-dimethylpropanoate
Also Known As: Em 800, BIDD:ER0061, SCH 57050, EM 776, EM800
| Molecular Formula | C39H47NO6 |
|---|---|
| Molecular Weight | 625.34 g/mol |
| LogP | 8.5187 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 625.34033 |
| Heavy Atoms | 46 |
| Complexity | 1568.6384 |
Chemical Identifiers
| CAS Number | 182167-03-9 |
|---|---|
| SMILES | CC1=C([C@@H](OC2=C1C=CC(=C2)OC(=O)C(C)(C)C)C3=CC=C(C=C3)OCCN4CCCCC4)C5=CC=C(C=C5)OC(=O)C(C)(C)C |
Product Overview
Em 800 (CAS 182167-03-9), with molecular formula C39H47NO6 and molecular weight 625.34 g/mol. IUPAC: [4-[(2S)-7-(2,2-dimethylpropanoyloxy)-4-methyl-2-[4-(2-piperidin-1-ylethoxy)phenyl]-2H-chromen-3-yl]phenyl] 2,2-dimethylpropanoate.
Chemical Property Profile of Em 800
Property Insights of Em 800
The XLogP value of 8.5187 indicates that Em 800 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Em 800. Following Lipinski's Rule of Five, Em 800 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Em 800?
The CAS number of Em 800 is 182167-03-9.
What is the molecular formula of Em 800?
The molecular formula of Em 800 is C39H47NO6.
What is the molecular weight of Em 800?
The molecular weight of Em 800 is 625.34 g/mol.
Where can I buy Em 800?
You can request a quote for Em 800 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Em 800?
Yes, KEHONG BIO provides custom synthesis services for Em 800 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.