ChemDiv1_010090
TL;DR: ChemDiv1_010090 (CAS 433946-21-5) is a chemical compound with molecular formula C28H29N3O5 and molecular weight 487.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-[3-(4-ethoxyphenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: ChemDiv1_010090, Dimethyl 4-(3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, DIMETHYL 4-[3-(4-ETHOXYPHENYL)-1-PHENYL-1H-PYRAZOL-4-YL]-2,6-DIMETHYL-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE, dimethyl 4-[3-(4-ethoxyphenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-dimethyl 4-[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
| Molecular Formula | C28H29N3O5 |
|---|---|
| Molecular Weight | 487.21 g/mol |
| LogP | 4.5188 |
| Topological Polar Surface Area | 91.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.21072 |
| Heavy Atoms | 36 |
| Complexity | 1299.2645 |
Chemical Identifiers
| CAS Number | 433946-21-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=C3C(=O)OC)C)C)C(=O)OC)C4=CC=CC=C4 |
Product Overview
ChemDiv1_010090 (CAS 433946-21-5), with molecular formula C28H29N3O5 and molecular weight 487.21 g/mol. IUPAC: dimethyl 4-[3-(4-ethoxyphenyl)-1-phenylpyrazol-4-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of ChemDiv1_010090
Property Insights of ChemDiv1_010090
The XLogP value of 4.5188 indicates that ChemDiv1_010090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.68 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_010090. Following Lipinski's Rule of Five, ChemDiv1_010090 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 ChemDiv1_010090?
The CAS number of ChemDiv1_010090 is 433946-21-5.
What is the molecular formula of ChemDiv1_010090?
The molecular formula of ChemDiv1_010090 is C28H29N3O5.
What is the molecular weight of ChemDiv1_010090?
The molecular weight of ChemDiv1_010090 is 487.21 g/mol.
Where can I buy ChemDiv1_010090?
You can request a quote for ChemDiv1_010090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010090?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.