RefChem:1051413
TL;DR: RefChem:1051413 (CAS 145071-51-8) is a chemical compound with molecular formula C16H20N2O5 and molecular weight 320.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4-dimethoxyphenyl) 5-[(E)-methoxyiminomethyl]-3,6-dihydro-2H-pyridine-1-carboxylate
Also Known As: 3,4-Dimethoxyphenyl (E)-3,6-dihydro-5-((methoxyimino)methyl)-1(2H)-pyridinecarboxylate, 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 3,4-dimethoxyphenyl ester, 1(2H)-Pyridinecarboxylic acid, 3,6-dihydro-5-((methoxyimino)methyl)-, 3,4-dimethoxyphenyl ester, (E)-, 1,2,5,6-Tetrahydro-3-methoxyiminomethyl-1-pyridinecarboxylic acid 3,4-dimethoxyphenyl ester, 3,4-dimethoxyphenyl 5-[(methoxyimino)methyl]-1,2,3,6-tetrahydropyridine-1-carboxylate
Technical Specifications
| Molecular Formula | C16H20N2O5 |
| Molecular Weight | 320.1372 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.1372 Da |
| Heavy Atoms | 23 |
| Complexity | 452.0 |
| SMILES | COC1=C(C=C(C=C1)OC(=O)N2CCC=C(C2)/C=N/OC)OC |
| InChIKey | KPOOBKIMNVCIAF-LICLKQGHSA-N |
Chemical Property Profile of RefChem:1051413
Property Insights of RefChem:1051413
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1051413. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1051413. Following Lipinski's Rule of Five, RefChem:1051413 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:1051413?
The CAS number of RefChem:1051413 is 145071-51-8.
What is the molecular formula of RefChem:1051413?
The molecular formula of RefChem:1051413 is C16H20N2O5.
What is the molecular weight of RefChem:1051413?
The molecular weight of RefChem:1051413 is 320.1372 g/mol.
Where can I buy RefChem:1051413?
You can request a quote for RefChem:1051413 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1051413?
Yes, CoreyChem provides custom synthesis services for RefChem:1051413 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.