Emd 21657
TL;DR: Emd 21657 (CAS 66735-56-6) is a chemical compound with molecular formula C12H20N2OS and molecular weight 240.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfanylmethyl)pyridin-3-ol
Also Known As: Tamitinol, Emd 21657, starbld0005532, 4-(2-(Ethylamino)ethyl)-2-methyl-5-((methylthio)methyl)-3-pyridinol, 4-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfanylmethyl)pyridin-3-ol
| Molecular Formula | C12H20N2OS |
|---|---|
| Molecular Weight | 240.13 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 70.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.12964 |
| Heavy Atoms | 16 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 66735-56-6 |
|---|---|
| SMILES | CCNCCC1=C(C(=NC=C1CSC)C)O |
| InChIKey | AIYWGDYVMBTAHH-UHFFFAOYSA-N |
Product Overview
Emd 21657 (CAS 66735-56-6), with molecular formula C12H20N2OS and molecular weight 240.13 g/mol. IUPAC: 4-[2-(ethylamino)ethyl]-2-methyl-5-(methylsulfanylmethyl)pyridin-3-ol.
Chemical Property Profile of Emd 21657
Property Insights of Emd 21657
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Emd 21657. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Emd 21657. Following Lipinski's Rule of Five, Emd 21657 has 2 hydrogen bond donor(s) and 4 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 Emd 21657?
The CAS number of Emd 21657 is 66735-56-6.
What is the molecular formula of Emd 21657?
The molecular formula of Emd 21657 is C12H20N2OS.
What is the molecular weight of Emd 21657?
The molecular weight of Emd 21657 is 240.13 g/mol.
Where can I buy Emd 21657?
You can request a quote for Emd 21657 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Emd 21657?
Yes, KEHONG BIO provides custom synthesis services for Emd 21657 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.