1,4-Dihydro-1,7-naphthyridin-4-one
TL;DR: 1,4-Dihydro-1,7-naphthyridin-4-one (CAS 53454-31-2) is a chemical compound with molecular formula C8H6N2O and molecular weight 146.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-1,7-naphthyridin-4-one
Also Known As: 1H-1,7-naphthyridin-4-one, 1,7-Naphthyridin-4(1H)-one, 1H-[1,7]Naphthyridin-4-one, 1,7-Naphthyridin-4-ol, [1,7]Naphthyridin-4-ol
| Molecular Formula | C8H6N2O |
|---|---|
| Molecular Weight | 146.05 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.04802 |
| Heavy Atoms | 11 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 53454-31-2 |
|---|---|
| SMILES | C1=CNC2=C(C1=O)C=CN=C2 |
| InChIKey | FRPQAFURNDRNEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dihydro-1,7-naphthyridin-4-one (CAS 53454-31-2), with molecular formula C8H6N2O and molecular weight 146.05 g/mol. IUPAC: 1H-1,7-naphthyridin-4-one.
Chemical Property Profile of 1,4-Dihydro-1,7-naphthyridin-4-one
Property Insights of 1,4-Dihydro-1,7-naphthyridin-4-one
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dihydro-1,7-naphthyridin-4-one. With a topological polar surface area (TPSA) of 42.0 Ų, 1,4-Dihydro-1,7-naphthyridin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dihydro-1,7-naphthyridin-4-one has 1 hydrogen bond donor(s) and 3 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 1,4-Dihydro-1,7-naphthyridin-4-one?
The CAS number of 1,4-Dihydro-1,7-naphthyridin-4-one is 53454-31-2.
What is the molecular formula of 1,4-Dihydro-1,7-naphthyridin-4-one?
The molecular formula of 1,4-Dihydro-1,7-naphthyridin-4-one is C8H6N2O.
What is the molecular weight of 1,4-Dihydro-1,7-naphthyridin-4-one?
The molecular weight of 1,4-Dihydro-1,7-naphthyridin-4-one is 146.05 g/mol.
Where can I buy 1,4-Dihydro-1,7-naphthyridin-4-one?
You can request a quote for 1,4-Dihydro-1,7-naphthyridin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dihydro-1,7-naphthyridin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dihydro-1,7-naphthyridin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.