SM 15178
TL;DR: SM 15178 (CAS 146461-98-5) is a chemical compound with molecular formula C22H26N2O6 and molecular weight 414.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[6-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]pyridine-2-carbonyl]-ethylamino]propanoic acid
Also Known As: beta-Alanine, N-((6-((4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl)-2-pyridinyl)carbonyl)-N-ethyl-, 3-[[6-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]pyridine-2-carbonyl]-ethylamino]propanoic acid, N-{6-[(4-Acetyl-2-ethyl-5-hydroxyphenoxy)methyl]pyridine-2-carbonyl}-N-ethyl-beta-alanine, RefChem:183378
| Molecular Formula | C22H26N2O6 |
|---|---|
| Molecular Weight | 414.18 g/mol |
| LogP | 3.068 |
| Topological Polar Surface Area | 117.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 414.17908 |
| Heavy Atoms | 30 |
| Complexity | 941.22015 |
Chemical Identifiers
| CAS Number | 146461-98-5 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1OCC2=NC(=CC=C2)C(=O)N(CC)CCC(=O)O)O)C(=O)C |
Product Overview
SM 15178 (CAS 146461-98-5), with molecular formula C22H26N2O6 and molecular weight 414.18 g/mol. IUPAC: 3-[[6-[(4-acetyl-2-ethyl-5-hydroxyphenoxy)methyl]pyridine-2-carbonyl]-ethylamino]propanoic acid.
Chemical Property Profile of SM 15178
Property Insights of SM 15178
The XLogP value of 3.068 indicates that SM 15178 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.03 Ų falls within the moderate polarity range, balancing permeability and solubility for SM 15178. Following Lipinski's Rule of Five, SM 15178 has 2 hydrogen bond donor(s) and 6 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 SM 15178?
The CAS number of SM 15178 is 146461-98-5.
What is the molecular formula of SM 15178?
The molecular formula of SM 15178 is C22H26N2O6.
What is the molecular weight of SM 15178?
The molecular weight of SM 15178 is 414.18 g/mol.
Where can I buy SM 15178?
You can request a quote for SM 15178 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SM 15178?
Yes, KEHONG BIO provides custom synthesis services for SM 15178 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.