![3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione structure](/static/products/5801/58013-71-1.webp)
3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione
TL;DR: 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione (CAS 58013-71-1) is a chemical compound with molecular formula C12H9Cl2NO2 and molecular weight 269.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione
Also Known As: 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione, 2,2-Dichloro-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-1,3(2H)-dione, RefChem:388687
| Molecular Formula | C12H9Cl2NO2 |
|---|---|
| Molecular Weight | 269.00 g/mol |
| LogP | 2.336 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.00104 |
| Heavy Atoms | 17 |
| Complexity | 539.3072 |
Chemical Identifiers
| CAS Number | 58013-71-1 |
|---|---|
| SMILES | C1CC2=C3C(=CC=C2)C(=O)C(C(=O)N3C1)(Cl)Cl |
Product Overview
3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione (CAS 58013-71-1), with molecular formula C12H9Cl2NO2 and molecular weight 269.00 g/mol. IUPAC: 3,3-dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione.
Chemical Property Profile of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione
Property Insights of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione
The XLogP value of 2.336 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione has 0 hydrogen bond donor(s) and 2 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 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione?
The CAS number of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione is 58013-71-1.
What is the molecular formula of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione?
The molecular formula of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione is C12H9Cl2NO2.
What is the molecular weight of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione?
The molecular weight of 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione is 269.00 g/mol.
Where can I buy 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione?
You can request a quote for 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dichloro-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.