RefChem:272158
TL;DR: RefChem:272158 (CAS 88045-98-1) is a chemical compound with molecular formula C17H23NO6 and molecular weight 337.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: BAS 01052234, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-4-(5,6-dihydro-1,4-dioxin-2-yl)-2,6-dimethyl-, diethyl ester, 3,5-Diethoxycarbonyl-4-(2'-(5',6'-dihydro-p-dioxinyl))-2,6-dimethyl-1,4-dihydropyridine, diethyl 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dih, 3,5-Pyridinedicarboxylicacid, 4-(5,6-dihydro-1,4-dioxin-2-yl)-1,4-dihydro-2,6-dimethyl-, 3,5-diethylester
| Molecular Formula | C17H23NO6 |
|---|---|
| Molecular Weight | 337.15 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 337.15253 |
| Heavy Atoms | 24 |
| Complexity | 577.0 |
Chemical Identifiers
| CAS Number | 88045-98-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=COCCO2)C(=O)OCC)C)C |
| InChIKey | BEJLLWYCSDDQRG-UHFFFAOYSA-N |
Product Overview
RefChem:272158 (CAS 88045-98-1), with molecular formula C17H23NO6 and molecular weight 337.15 g/mol. IUPAC: diethyl 4-(2,3-dihydro-1,4-dioxin-5-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of RefChem:272158
Property Insights of RefChem:272158
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:272158. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:272158. Following Lipinski's Rule of Five, RefChem:272158 has 1 hydrogen bond donor(s) and 7 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 RefChem:272158?
The CAS number of RefChem:272158 is 88045-98-1.
What is the molecular formula of RefChem:272158?
The molecular formula of RefChem:272158 is C17H23NO6.
What is the molecular weight of RefChem:272158?
The molecular weight of RefChem:272158 is 337.15 g/mol.
Where can I buy RefChem:272158?
You can request a quote for RefChem:272158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:272158?
Yes, KEHONG BIO provides custom synthesis services for RefChem:272158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.