ChemDiv1_004827
TL;DR: ChemDiv1_004827 (CAS 361477-90-9) is a chemical compound with molecular formula C24H20N4O3S and molecular weight 444.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(4-ethoxyphenyl)-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile
Also Known As: ChemDiv1_004827, 2-amino-4-(4-ethoxyphenyl)-6-((2-(4-methoxyphenyl)-2-oxoethyl)thio)pyridine-3,5-dicarbonitrile, 2-amino-4-(4-ethoxyphenyl)-6-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile, F0422-0080, 2-amino-4-(4-ethoxyphenyl)-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile
| Molecular Formula | C24H20N4O3S |
|---|---|
| Molecular Weight | 444.13 g/mol |
| LogP | 4.45646 |
| Topological Polar Surface Area | 122.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.1256 |
| Heavy Atoms | 32 |
| Complexity | 1210.4673 |
Chemical Identifiers
| CAS Number | 361477-90-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCC(=O)C3=CC=C(C=C3)OC)N)C#N |
Product Overview
ChemDiv1_004827 (CAS 361477-90-9), with molecular formula C24H20N4O3S and molecular weight 444.13 g/mol. IUPAC: 2-amino-4-(4-ethoxyphenyl)-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile.
Chemical Property Profile of ChemDiv1_004827
Property Insights of ChemDiv1_004827
The XLogP value of 4.45646 indicates that ChemDiv1_004827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.02 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_004827. Following Lipinski's Rule of Five, ChemDiv1_004827 has 1 hydrogen bond donor(s) and 8 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 ChemDiv1_004827?
The CAS number of ChemDiv1_004827 is 361477-90-9.
What is the molecular formula of ChemDiv1_004827?
The molecular formula of ChemDiv1_004827 is C24H20N4O3S.
What is the molecular weight of ChemDiv1_004827?
The molecular weight of ChemDiv1_004827 is 444.13 g/mol.
Where can I buy ChemDiv1_004827?
You can request a quote for ChemDiv1_004827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_004827?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_004827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.