ChemDiv3_014021
TL;DR: ChemDiv3_014021 (CAS 347320-27-8) is a chemical compound with molecular formula C19H25NO4S and molecular weight 363.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 1,2,6-trimethyl-4-(5-methylthiophen-2-yl)-4H-pyridine-3,5-dicarboxylate
Also Known As: ChemDiv3_014021, BAS 03363665, A2555/0108822, diethyl 1,2,6-trimethyl-4-(5-methylthiophen-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate, Diethyl 1,2,6-trimethyl-4-(5-methyl-2-thienyl)-1,4-dihydro-3,5-pyridinedicarboxylate #
| Molecular Formula | C19H25NO4S |
|---|---|
| Molecular Weight | 363.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 84.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 363.15042 |
| Heavy Atoms | 25 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 347320-27-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(C(=C(C1C2=CC=C(S2)C)C(=O)OCC)C)C)C |
| InChIKey | YNDCSDABJFNNIR-UHFFFAOYSA-N |
Product Overview
ChemDiv3_014021 (CAS 347320-27-8), with molecular formula C19H25NO4S and molecular weight 363.15 g/mol. IUPAC: diethyl 1,2,6-trimethyl-4-(5-methylthiophen-2-yl)-4H-pyridine-3,5-dicarboxylate.
Chemical Property Profile of ChemDiv3_014021
Property Insights of ChemDiv3_014021
The XLogP value of 3.5 indicates that ChemDiv3_014021 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.1 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_014021. Following Lipinski's Rule of Five, ChemDiv3_014021 has 0 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 ChemDiv3_014021?
The CAS number of ChemDiv3_014021 is 347320-27-8.
What is the molecular formula of ChemDiv3_014021?
The molecular formula of ChemDiv3_014021 is C19H25NO4S.
What is the molecular weight of ChemDiv3_014021?
The molecular weight of ChemDiv3_014021 is 363.15 g/mol.
Where can I buy ChemDiv3_014021?
You can request a quote for ChemDiv3_014021 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_014021?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_014021 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.