Bay K 8644
TL;DR: Bay K 8644 (CAS 71145-03-4) is a chemical compound with molecular formula C16H15F3N2O4 and molecular weight 356.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
Also Known As: Bay K 8644, (+/-)-BAY K 8644, BAY-K-8644, Bay K8644, methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C16H15F3N2O4 |
|---|---|
| Molecular Weight | 356.10 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.0984 |
| Heavy Atoms | 25 |
| Complexity | 634.0 |
Chemical Identifiers
| CAS Number | 71145-03-4 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2C(F)(F)F)C(=O)OC |
| InChIKey | ZFLWDHHVRRZMEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bay K 8644 (CAS 71145-03-4), with molecular formula C16H15F3N2O4 and molecular weight 356.10 g/mol. IUPAC: methyl 2,6-dimethyl-5-nitro-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylate.
Chemical Property Profile of Bay K 8644
Property Insights of Bay K 8644
The XLogP value of 3.4 indicates that Bay K 8644 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Bay K 8644. Following Lipinski's Rule of Five, Bay K 8644 has 1 hydrogen bond donor(s) and 8 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 Bay K 8644?
The CAS number of Bay K 8644 is 71145-03-4.
What is the molecular formula of Bay K 8644?
The molecular formula of Bay K 8644 is C16H15F3N2O4.
What is the molecular weight of Bay K 8644?
The molecular weight of Bay K 8644 is 356.10 g/mol.
Where can I buy Bay K 8644?
You can request a quote for Bay K 8644 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bay K 8644?
Yes, KEHONG BIO provides custom synthesis services for Bay K 8644 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.