RefChem:1066008
TL;DR: RefChem:1066008 (CAS 5181-75-9) is a chemical compound with molecular formula C19H20FNO4 and molecular weight 345.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-O-methyl 5-O-prop-2-enyl 4-(2-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Also Known As: Methyl 2-propenyl 2,6-dimethyl-4-(2-fluorophenyl)-1,4-dihydro-3,5-pyridinedicarboxylate, methyl prop-2-en-1-yl 4-(2-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-fluorophenyl)-, methyl 2-propenyl ester, 3-O-methyl 5-O-prop-2-enyl 4-(2-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate, RefChem:1066008
| Molecular Formula | C19H20FNO4 |
|---|---|
| Molecular Weight | 345.14 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.13763 |
| Heavy Atoms | 25 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 5181-75-9 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCC=C)C2=CC=CC=C2F)C(=O)OC |
| InChIKey | MUMTTZTWVFEGKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:1066008 (CAS 5181-75-9), with molecular formula C19H20FNO4 and molecular weight 345.14 g/mol. IUPAC: 3-O-methyl 5-O-prop-2-enyl 4-(2-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate.
Chemical Property Profile of RefChem:1066008
Property Insights of RefChem:1066008
The XLogP value of 3.1 indicates that RefChem:1066008 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1066008. Following Lipinski's Rule of Five, RefChem:1066008 has 1 hydrogen bond donor(s) and 6 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 RefChem:1066008?
The CAS number of RefChem:1066008 is 5181-75-9.
What is the molecular formula of RefChem:1066008?
The molecular formula of RefChem:1066008 is C19H20FNO4.
What is the molecular weight of RefChem:1066008?
The molecular weight of RefChem:1066008 is 345.14 g/mol.
Where can I buy RefChem:1066008?
You can request a quote for RefChem:1066008 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1066008?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1066008 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.