![1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione structure](/static/products/6702/670259-05-9.webp)
1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione
TL;DR: 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione (CAS 670259-05-9) is a chemical compound with molecular formula C20H14ClNO3 and molecular weight 351.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-chloro-16-(1-hydroxybutylidene)-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13-heptaene-8,15-dione
Also Known As: 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione
| Molecular Formula | C20H14ClNO3 |
|---|---|
| Molecular Weight | 351.07 g/mol |
| LogP | 3.10958 |
| Topological Polar Surface Area | 67.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.06622 |
| Heavy Atoms | 25 |
| Complexity | 1364.687 |
Chemical Identifiers
| CAS Number | 670259-05-9 |
|---|---|
| SMILES | CCCC(=C1C2=C3C(=NC1=O)C=CC(=C3C(=O)C4=CC=CC=C42)Cl)O |
Product Overview
1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione (CAS 670259-05-9), with molecular formula C20H14ClNO3 and molecular weight 351.07 g/mol. IUPAC: 10-chloro-16-(1-hydroxybutylidene)-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(17),2,4,6,9,11,13-heptaene-8,15-dione.
Chemical Property Profile of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione
Property Insights of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione
The XLogP value of 3.10958 indicates that 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione. Following Lipinski's Rule of Five, 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione 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 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione?
The CAS number of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione is 670259-05-9.
What is the molecular formula of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione?
The molecular formula of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione is C20H14ClNO3.
What is the molecular weight of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione?
The molecular weight of 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione is 351.07 g/mol.
Where can I buy 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione?
You can request a quote for 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-butyryl-6-chloro-3H-naphtho[1,2,3-de]quinoline-2,7-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.