![2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE structure](/static/products/4029/402954-28-3.webp)
2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE
TL;DR: 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE (CAS 402954-28-3) is a chemical compound with molecular formula C31H28N6OS2 and molecular weight 564.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-amino-5-cyano-1-(4-phenyl-1,3-thiazol-2-yl)-3-azaspiro[5.5]undeca-2,4-dien-4-yl]sulfanyl]-N-quinolin-8-ylacetamide
Also Known As: 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE, F0894-0266, 2-((1-cyano-4-imino-5-(4-phenylthiazol-2-yl)-3-azaspiro[5.5]undec-1-en-2-yl)thio)-N-(quinolin-8-yl)acetamide, 2-((4-Amino-1-cyano-5-(4-phenylthiazol-2-yl)-3-azaspiro[5.5]undeca-1,3-dien-2-yl)thio)-N-(quinolin-8-yl)acetamide, 2-[[2-amino-5-cyano-1-(4-phenyl-1,3-thiazol-2-yl)-3-azaspiro[5.5]undeca-2,4-dien-4-yl]sulfanyl]-N-quinolin-8-ylacetamide
| Molecular Formula | C31H28N6OS2 |
|---|---|
| Molecular Weight | 564.18 g/mol |
| LogP | 6.87028 |
| Topological Polar Surface Area | 117.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 564.1766 |
| Heavy Atoms | 40 |
| Complexity | 1658.6642 |
Chemical Identifiers
| CAS Number | 402954-28-3 |
|---|---|
| SMILES | C1CCC2(CC1)C(C(=NC(=C2C#N)SCC(=O)NC3=CC=CC4=C3N=CC=C4)N)C5=NC(=CS5)C6=CC=CC=C6 |
Product Overview
2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE (CAS 402954-28-3), with molecular formula C31H28N6OS2 and molecular weight 564.18 g/mol. IUPAC: 2-[[2-amino-5-cyano-1-(4-phenyl-1,3-thiazol-2-yl)-3-azaspiro[5.5]undeca-2,4-dien-4-yl]sulfanyl]-N-quinolin-8-ylacetamide.
Chemical Property Profile of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE
Property Insights of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE
The XLogP value of 6.87028 indicates that 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE. Following Lipinski's Rule of Five, 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE?
The CAS number of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE is 402954-28-3.
What is the molecular formula of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE?
The molecular formula of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE is C31H28N6OS2.
What is the molecular weight of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE?
The molecular weight of 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE is 564.18 g/mol.
Where can I buy 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE?
You can request a quote for 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE?
Yes, KEHONG BIO provides custom synthesis services for 2-{[1-CYANO-4-IMINO-5-(4-PHENYL-1,3-THIAZOL-2-YL)-3-AZASPIRO[5.5]UNDEC-1-EN-2-YL]SULFANYL}-N-(QUINOLIN-8-YL)ACETAMIDE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.