BAS 00437604
TL;DR: BAS 00437604 (CAS 327090-58-4) is a chemical compound with molecular formula C20H19F5N2O6 and molecular weight 478.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-[2-(difluoromethoxy)-5-[(2,2,2-trifluoroacetyl)amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: BAS 00437604, dimethyl 4-[2-(difluoromethoxy)-5-[(2,2,2-trifluoroacetyl)amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 4-(2-(difluoromethoxy)-5-(2,2,2-trifluoroacetamido)phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, dimethyl 4-{2-(difluoromethoxy)-5-[(trifluoroacetyl)amino]phenyl}-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate
| Molecular Formula | C20H19F5N2O6 |
|---|---|
| Molecular Weight | 478.12 g/mol |
| LogP | 3.3696 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 478.11633 |
| Heavy Atoms | 33 |
| Complexity | 994.26196 |
Chemical Identifiers
| CAS Number | 327090-58-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC)C2=C(C=CC(=C2)NC(=O)C(F)(F)F)OC(F)F)C(=O)OC |
Product Overview
BAS 00437604 (CAS 327090-58-4), with molecular formula C20H19F5N2O6 and molecular weight 478.12 g/mol. IUPAC: dimethyl 4-[2-(difluoromethoxy)-5-[(2,2,2-trifluoroacetyl)amino]phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of BAS 00437604
Property Insights of BAS 00437604
The XLogP value of 3.3696 indicates that BAS 00437604 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.96 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00437604. Following Lipinski's Rule of Five, BAS 00437604 has 2 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 BAS 00437604?
The CAS number of BAS 00437604 is 327090-58-4.
What is the molecular formula of BAS 00437604?
The molecular formula of BAS 00437604 is C20H19F5N2O6.
What is the molecular weight of BAS 00437604?
The molecular weight of BAS 00437604 is 478.12 g/mol.
Where can I buy BAS 00437604?
You can request a quote for BAS 00437604 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00437604?
Yes, KEHONG BIO provides custom synthesis services for BAS 00437604 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.