N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide
TL;DR: N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide (CAS 852829-87-9) is a chemical compound with molecular formula C21H20N4OS2 and molecular weight 408.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-cyanocyclohexyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide
Also Known As: starbld0002761, AB01300414-01, N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide, N-(1-Cyanocyclohexyl)-2-((2-(thiophen-2-yl)quinazolin-4-yl)thio)acetamide, N-(1-cyanocyclohexyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide
| Molecular Formula | C21H20N4OS2 |
|---|---|
| Molecular Weight | 408.11 g/mol |
| LogP | 4.79308 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.10785 |
| Heavy Atoms | 28 |
| Complexity | 1020.56165 |
Chemical Identifiers
| CAS Number | 852829-87-9 |
|---|---|
| SMILES | C1CCC(CC1)(C#N)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4 |
Product Overview
N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide (CAS 852829-87-9), with molecular formula C21H20N4OS2 and molecular weight 408.11 g/mol. IUPAC: N-(1-cyanocyclohexyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide.
Chemical Property Profile of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide
Property Insights of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide
The XLogP value of 4.79308 indicates that N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide. Following Lipinski's Rule of Five, N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide has 1 hydrogen bond donor(s) and 6 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 N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide?
The CAS number of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide is 852829-87-9.
What is the molecular formula of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide?
The molecular formula of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide is C21H20N4OS2.
What is the molecular weight of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide?
The molecular weight of N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide is 408.11 g/mol.
Where can I buy N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide?
You can request a quote for N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1-cyanocyclohexyl)-2-{[2-(thiophen-2-yl)quinazolin-4-yl]sulfanyl}acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.