RefChem:1053591
TL;DR: RefChem:1053591 (CAS 90679-45-1) is a chemical compound with molecular formula C16H12FN3O3 and molecular weight 313.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-6-fluoro-4-oxo-7-pyridin-4-yl-1,8-naphthyridine-3-carboxylic acid
Also Known As: 1-Ethyl-6-fluoro-4-oxo-7-(pyridin-4-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid, 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethyl-6-fluoro-4-oxo-7-(4-pyridinyl)-, 1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(4-pyridyl)-1,8-naphthyridine-3-carboxylic acid, 1,4-Dihydro-1-ethyl-6-fluoro-4-oxo-7-(4-pyridinyl)-1,8-naphthyridine-3-carboxylic acid, 1-ethyl-6-fluoro-4-oxo-7-pyridin-4-yl-1,8-naphthyridine-3-carboxylic acid
| Molecular Formula | C16H12FN3O3 |
|---|---|
| Molecular Weight | 313.09 g/mol |
| LogP | 2.3157 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 313.08627 |
| Heavy Atoms | 23 |
| Complexity | 967.70667 |
Chemical Identifiers
| CAS Number | 90679-45-1 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(N=C21)C3=CC=NC=C3)F)C(=O)O |
Product Overview
RefChem:1053591 (CAS 90679-45-1), with molecular formula C16H12FN3O3 and molecular weight 313.09 g/mol. IUPAC: 1-ethyl-6-fluoro-4-oxo-7-pyridin-4-yl-1,8-naphthyridine-3-carboxylic acid.
Chemical Property Profile of RefChem:1053591
Property Insights of RefChem:1053591
The XLogP value of 2.3157 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1053591. The TPSA of 85.08 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1053591. Following Lipinski's Rule of Five, RefChem:1053591 has 1 hydrogen bond donor(s) and 4 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:1053591?
The CAS number of RefChem:1053591 is 90679-45-1.
What is the molecular formula of RefChem:1053591?
The molecular formula of RefChem:1053591 is C16H12FN3O3.
What is the molecular weight of RefChem:1053591?
The molecular weight of RefChem:1053591 is 313.09 g/mol.
Where can I buy RefChem:1053591?
You can request a quote for RefChem:1053591 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1053591?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1053591 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.