![8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile structure](/static/products/369/369608-87-7.png)
8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile
TL;DR: 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile (CAS 369608-87-7) is a chemical compound with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxo-4-phenacylsulfanyl-3-azaspiro[5.5]undec-4-ene-1,5-dicarbonitrile
Also Known As: 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile, 4-oxo-2-((2-oxo-2-phenylethyl)thio)-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile, 4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile, 4-hydroxy-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarbonitrile
| Molecular Formula | C20H19N3O2S |
|---|---|
| Molecular Weight | 365.12 g/mol |
| LogP | 3.55776 |
| Topological Polar Surface Area | 93.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.1198 |
| Heavy Atoms | 26 |
| Complexity | 826.85254 |
Chemical Identifiers
| CAS Number | 369608-87-7 |
|---|---|
| SMILES | C1CCC2(CC1)C(C(=O)NC(=C2C#N)SCC(=O)C3=CC=CC=C3)C#N |
Product Overview
8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile (CAS 369608-87-7), with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol. IUPAC: 2-oxo-4-phenacylsulfanyl-3-azaspiro[5.5]undec-4-ene-1,5-dicarbonitrile.
Chemical Property Profile of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile
Property Insights of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile
The XLogP value of 3.55776 indicates that 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile. Following Lipinski's Rule of Five, 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile has 1 hydrogen bond donor(s) and 5 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-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile?
The CAS number of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile is 369608-87-7.
What is the molecular formula of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile?
The molecular formula of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile is C20H19N3O2S.
What is the molecular weight of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile?
The molecular weight of 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile is 365.12 g/mol.
Where can I buy 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile?
You can request a quote for 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 8-oxo-10-phenacylsulfanyl-9-azaspiro[5.5]undec-10-ene-7,11-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.