Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
TL;DR: Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate (CAS 669735-16-4) is a chemical compound with molecular formula C15H14ClNO4 and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: BAS 09589178, AB00341675-03, dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate, A3332/0141528, 3,5-DIMETHYL 4-(3-CHLOROPHENYL)-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C15H14ClNO4 |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.06113 |
| Heavy Atoms | 21 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 669735-16-4 |
|---|---|
| SMILES | COC(=O)C1=CNC=C(C1C2=CC(=CC=C2)Cl)C(=O)OC |
| InChIKey | KRGFXXZMOLBICE-UHFFFAOYSA-N |
Product Overview
Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate (CAS 669735-16-4), with molecular formula C15H14ClNO4 and molecular weight 307.06 g/mol. IUPAC: dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Property Insights of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate has 1 hydrogen bond donor(s) and 5 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 Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate?
The CAS number of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate is 669735-16-4.
What is the molecular formula of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate?
The molecular formula of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate is C15H14ClNO4.
What is the molecular weight of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate?
The molecular weight of Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate is 307.06 g/mol.
Where can I buy Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate?
You can request a quote for Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.