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7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
TL;DR: 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione (CAS 446868-40-2) is a chemical compound with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
Also Known As: 7-phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione, 8-phenyl-3,4,8-triazaspiro[4.4]non-3-ene-7,9-dione
| Molecular Formula | C12H11N3O2 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | 1.5446 |
| Topological Polar Surface Area | 62.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.08513 |
| Heavy Atoms | 17 |
| Complexity | 511.74185 |
Chemical Identifiers
| CAS Number | 446868-40-2 |
|---|---|
| SMILES | C1CN=NC12CC(=O)N(C2=O)C3=CC=CC=C3 |
Product Overview
7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione (CAS 446868-40-2), with molecular formula C12H11N3O2 and molecular weight 229.09 g/mol. IUPAC: 7-phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione.
Chemical Property Profile of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
Property Insights of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione
The XLogP value of 1.5446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Phenyl-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 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione. Following Lipinski's Rule of Five, 7-Phenyl-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 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
The CAS number of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione is 446868-40-2.
What is the molecular formula of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
The molecular formula of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione is C12H11N3O2.
What is the molecular weight of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
The molecular weight of 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione is 229.09 g/mol.
Where can I buy 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
You can request a quote for 7-Phenyl-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 7-Phenyl-1,2,7-triazaspiro[4.4]non-1-ene-6,8-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Phenyl-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.