1,8-萘啶
TL;DR: 1,8-萘啶 (CAS 254-60-4) is a chemical compound with molecular formula C19H17NO2 and molecular weight 291.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-萘啶
2-(4-ethylphenyl)-3-methylquinoline-4-carboxylic acid
Also Known As: 2-(4-ethylphenyl)-3-methylquinoline-4-carboxylic acid, [1,8]Naphthyridine, 2-(4-ethylphenyl)-3-methyl-quinoline-4-carboxylic Acid, 2-(4-ETHYLPHENYL)-3-METHYLQUINOLINE-4-CARBOXYLICACID, 4-Quinolinecarboxylic acid, 2-(4-ethylphenyl)-3-methyl-
| Molecular Formula | C19H17NO2 |
|---|---|
| Molecular Weight | 291.13 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.12592 |
| Heavy Atoms | 22 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 254-60-4 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2C)C(=O)O |
| InChIKey | NPNBUHRSRXZKLR-UHFFFAOYSA-N |
Product Overview
1,8-萘啶 (CAS 254-60-4), with molecular formula C19H17NO2 and molecular weight 291.13 g/mol. IUPAC: 2-(4-ethylphenyl)-3-methylquinoline-4-carboxylic acid.
Chemical Property Profile of 1,8-萘啶
Property Insights of 1,8-萘啶
The XLogP value of 4.5 indicates that 1,8-萘啶 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 1,8-萘啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,8-萘啶 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 1,8-萘啶?
The CAS number of 1,8-萘啶 is 254-60-4.
What is the molecular formula of 1,8-萘啶?
The molecular formula of 1,8-萘啶 is C19H17NO2.
What is the molecular weight of 1,8-萘啶?
The molecular weight of 1,8-萘啶 is 291.13 g/mol.
Where can I buy 1,8-萘啶?
You can request a quote for 1,8-萘啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8-萘啶?
Yes, KEHONG BIO provides custom synthesis services for 1,8-萘啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.