![2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile structure](/static/products/1023/1023481-81-3.webp)
2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile
TL;DR: 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile (CAS 1023481-81-3) is a chemical compound with molecular formula C16H18N4S and molecular weight 298.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile
Also Known As: 2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile, 2-((4-(cyclohexylamino)quinazolin-2-yl)thio)acetonitrile, 2-{[4-(cyclohexylamino)quinazolin-2-yl]sulfanyl}acetonitrile, F6548-4542
| Molecular Formula | C16H18N4S |
|---|---|
| Molecular Weight | 298.13 g/mol |
| LogP | 3.99008 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 298.1252 |
| Heavy Atoms | 21 |
| Complexity | 658.8648 |
Chemical Identifiers
| CAS Number | 1023481-81-3 |
|---|---|
| SMILES | C1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)SCC#N |
Product Overview
2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile (CAS 1023481-81-3), with molecular formula C16H18N4S and molecular weight 298.13 g/mol. IUPAC: 2-[4-(cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile.
Chemical Property Profile of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile
Property Insights of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile
The XLogP value of 3.99008 indicates that 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile. Following Lipinski's Rule of Five, 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile 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 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile?
The CAS number of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile is 1023481-81-3.
What is the molecular formula of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile?
The molecular formula of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile is C16H18N4S.
What is the molecular weight of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile?
The molecular weight of 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile is 298.13 g/mol.
Where can I buy 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile?
You can request a quote for 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(Cyclohexylamino)quinazolin-2-yl]sulfanylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.