![[4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile structure](/static/products/4979/497933-44-5.webp)
[4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile
TL;DR: [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile (CAS 497933-44-5) is a chemical compound with molecular formula C15H18N2S and molecular weight 258.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1-adamantyl)-1,3-thiazol-2-yl]acetonitrile
Also Known As: [4-(1-adamantyl)-1,3-thiazol-2-yl]acetonitrile|2-[4-(adamantan-1-yl)-1,3-thiazol-2-yl]acetonitrile|4-(1-adamantyl)-2-cyanomethylthiazole|2-[4-(1-adamantyl)-1,3-thiazol-2-yl]acetonitrile|2-(4-(Adamantan-1-yl)thiazol-2-yl)acetonitrile|2-[4-(1-adamantyl)thiazol-2-yl]acetonitrile|(4-Adamantan-1-yl-thiazol-2-yl)-acetonitrile|2-Thiazoleacetonitrile, 4-tricyclo[3.3.1.13,7]dec-1-yl-|4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile|2-(4-adamantanyl-1,3-thiazol-2-yl)ethanenitrile|2-4-(Adamantan-1-yl)-1,3-thiazol-2-ylacetonitrile|A4045/0172527|2-Thiazoleacetonitrile, 4-tricyclo[3.3.1.1(3,7)]dec-1-yl-|[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]acetonitrile|MFCD06655934|KKWHZLLDUUVCAT-UHFFFAOYSA-N|EN300-13571
| Molecular Formula | C15H18N2S |
|---|---|
| Molecular Weight | 258.12 g/mol |
| LogP | 3.67698 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.11908 |
| Heavy Atoms | 18 |
| Complexity | 475.52423 |
Chemical Identifiers
| CAS Number | 497933-44-5 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)CC#N |
Product Overview
[4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile (CAS 497933-44-5), with molecular formula C15H18N2S and molecular weight 258.12 g/mol. IUPAC: 2-[4-(1-adamantyl)-1,3-thiazol-2-yl]acetonitrile.
Chemical Property Profile of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile
Property Insights of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile
The XLogP value of 3.67698 indicates that [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile has 0 hydrogen bond donor(s) and 3 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 [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile?
The CAS number of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile is 497933-44-5.
What is the molecular formula of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile?
The molecular formula of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile is C15H18N2S.
What is the molecular weight of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile?
The molecular weight of [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile is 258.12 g/mol.
Where can I buy [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile?
You can request a quote for [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for [4-(1-Adamantyl)-1,3-thiazol-2-yl]acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.