RefChem:586434
TL;DR: RefChem:586434 (CAS 421580-75-8) is a chemical compound with molecular formula C33H27Cl2NO5 and molecular weight 587.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzyl 4-[5-(2,5-dichlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: Dibenzyl 4-[5-(2,5-dichlorophenyl)-2-furyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, Dibenzyl 4-(5-(2,5-dichlorophenyl)furan-2-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, DIBENZYL 4-[5-(2,5-DICHLOROPHENYL)-2-FURYL]-2,6-DIMETHYL-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE, dibenzyl 4-[5-(2,5-dichlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-DIBENZYL 4-[5-(2,5-DICHLOROPHENYL)FURAN-2-YL]-2,6-DIMETHYL-1,4-DIHYDROPYRIDINE-3,5-DICARBOXYLATE
| Molecular Formula | C33H27Cl2NO5 |
|---|---|
| Molecular Weight | 587.13 g/mol |
| LogP | 7.975 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 587.12665 |
| Heavy Atoms | 41 |
| Complexity | 1563.111 |
Chemical Identifiers
| CAS Number | 421580-75-8 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCC2=CC=CC=C2)C3=CC=C(O3)C4=C(C=CC(=C4)Cl)Cl)C(=O)OCC5=CC=CC=C5 |
Product Overview
RefChem:586434 (CAS 421580-75-8), with molecular formula C33H27Cl2NO5 and molecular weight 587.13 g/mol. IUPAC: dibenzyl 4-[5-(2,5-dichlorophenyl)furan-2-yl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of RefChem:586434
Property Insights of RefChem:586434
The XLogP value of 7.975 indicates that RefChem:586434 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.77 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:586434. Following Lipinski's Rule of Five, RefChem:586434 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:586434?
The CAS number of RefChem:586434 is 421580-75-8.
What is the molecular formula of RefChem:586434?
The molecular formula of RefChem:586434 is C33H27Cl2NO5.
What is the molecular weight of RefChem:586434?
The molecular weight of RefChem:586434 is 587.13 g/mol.
Where can I buy RefChem:586434?
You can request a quote for RefChem:586434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:586434?
Yes, KEHONG BIO provides custom synthesis services for RefChem:586434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.