![3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione structure](/static/products/6972/697230-78-7.webp)
3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
TL;DR: 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione (CAS 697230-78-7) is a chemical compound with molecular formula C12H9ClFN3O2 and molecular weight 281.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
Also Known As: BAS 07804428, 3-chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione, A3617/0153341, 2-chloro-8-(4-fluorophenyl)-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione, 3-chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro-[4.4]non-1-ene-6,8-dione
| Molecular Formula | C12H9ClFN3O2 |
|---|---|
| Molecular Weight | 281.04 g/mol |
| LogP | 2.2486 |
| Topological Polar Surface Area | 62.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 281.03674 |
| Heavy Atoms | 19 |
| Complexity | 589.1422 |
Chemical Identifiers
| CAS Number | 697230-78-7 |
|---|---|
| SMILES | C1C(N=NC12CC(=O)N(C2=O)C3=CC=C(C=C3)F)Cl |
Product Overview
3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione (CAS 697230-78-7), with molecular formula C12H9ClFN3O2 and molecular weight 281.04 g/mol. IUPAC: 3-chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione.
Chemical Property Profile of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
Property Insights of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
The XLogP value of 2.2486 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione. The TPSA of 62.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione. Following Lipinski's Rule of Five, 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione has 0 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 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
The CAS number of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione is 697230-78-7.
What is the molecular formula of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
The molecular formula of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione is C12H9ClFN3O2.
What is the molecular weight of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
The molecular weight of 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione is 281.04 g/mol.
Where can I buy 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
You can request a quote for 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-7-(4-fluorophenyl)-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.