RefChem:1066025
TL;DR: RefChem:1066025 (CAS 71160-19-5) is a chemical compound with molecular formula C19H21NO5 and molecular weight 343.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-[(1E,3E)-4-(furan-2-yl)buta-1,3-dienyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(4-(2-furanyl)-1,3-butadienyl)-, dimethyl ester, dimethyl 4-[(1E,3E)-4-(furan-2-yl)buta-1,3-dienyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, RefChem:1066025, BRN 1161237
| Molecular Formula | C19H21NO5 |
|---|---|
| Molecular Weight | 343.14 g/mol |
| LogP | 2.9624 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.14197 |
| Heavy Atoms | 25 |
| Complexity | 727.74493 |
Chemical Identifiers
| CAS Number | 71160-19-5 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC)/C=C/C=C/C2=CC=CO2)C(=O)OC |
Product Overview
RefChem:1066025 (CAS 71160-19-5), with molecular formula C19H21NO5 and molecular weight 343.14 g/mol. IUPAC: dimethyl 4-[(1E,3E)-4-(furan-2-yl)buta-1,3-dienyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of RefChem:1066025
Property Insights of RefChem:1066025
The XLogP value of 2.9624 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1066025. The TPSA of 77.77 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1066025. Following Lipinski's Rule of Five, RefChem:1066025 has 1 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 RefChem:1066025?
The CAS number of RefChem:1066025 is 71160-19-5.
What is the molecular formula of RefChem:1066025?
The molecular formula of RefChem:1066025 is C19H21NO5.
What is the molecular weight of RefChem:1066025?
The molecular weight of RefChem:1066025 is 343.14 g/mol.
Where can I buy RefChem:1066025?
You can request a quote for RefChem:1066025 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066025?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066025 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.