![2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile structure](/static/products/3816/381679-64-7.webp)
2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile
TL;DR: 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile (CAS 381679-64-7) is a chemical compound with molecular formula C17H15BrN2S and molecular weight 358.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile
Also Known As: ChemDiv1_028772, 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile, J2.916.768K, [4-(4-Bromo-phenyl)-thiazol-2-yl]-cyclohexylidene-acetonitrile, F0894-0368
| Molecular Formula | C17H15BrN2S |
|---|---|
| Molecular Weight | 358.01 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 64.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.01392 |
| Heavy Atoms | 21 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 381679-64-7 |
|---|---|
| SMILES | C1CCC(=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Br)CC1 |
| InChIKey | RUELNPKPCSHVHG-UHFFFAOYSA-N |
Product Overview
2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile (CAS 381679-64-7), with molecular formula C17H15BrN2S and molecular weight 358.01 g/mol. IUPAC: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile.
Chemical Property Profile of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile
Property Insights of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile
The XLogP value of 5.0 indicates that 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile. Following Lipinski's Rule of Five, 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile 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 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile?
The CAS number of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile is 381679-64-7.
What is the molecular formula of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile?
The molecular formula of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile is C17H15BrN2S.
What is the molecular weight of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile?
The molecular weight of 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile is 358.01 g/mol.
Where can I buy 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile?
You can request a quote for 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-Bromophenyl)-1,3-thiazol-2-yl]-2-cyclohexylideneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.