8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine
TL;DR: 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine (CAS 85547-22-4) is a chemical compound with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,12-dimethoxy-2,6-diazatricyclo[7.3.1.05,13]trideca-1,3,5(13),7,9,11-hexaene
Also Known As: Aaptamine, dimethoxy[?], Aaptamine [M+H]+, 8,9-dimethoxy-1H-benzo[de][1,6]naphthyridine, 1H-Benzo(de)(1,6)naphthyridine, 8,9-dimethoxy-
| Molecular Formula | C13H12N2O2 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.08987 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 85547-22-4 |
|---|---|
| SMILES | COC1=C(C2=NC=CC3=C2C(=C1)C=CN3)OC |
| InChIKey | UERYGOYPBXIFQV-UHFFFAOYSA-N |
Product Overview
8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine (CAS 85547-22-4), with molecular formula C13H12N2O2 and molecular weight 228.09 g/mol. IUPAC: 11,12-dimethoxy-2,6-diazatricyclo[7.3.1.05,13]trideca-1,3,5(13),7,9,11-hexaene.
Chemical Property Profile of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine
Property Insights of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine. With a topological polar surface area (TPSA) of 43.4 Ų, 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine 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 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine?
The CAS number of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine is 85547-22-4.
What is the molecular formula of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine?
The molecular formula of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine is C13H12N2O2.
What is the molecular weight of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine?
The molecular weight of 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine is 228.09 g/mol.
Where can I buy 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine?
You can request a quote for 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine?
Yes, KEHONG BIO provides custom synthesis services for 8,9-Dimethoxy-4H-benzo(de)(1,6)naphthyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.