![(Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile structure](/static/products/1020/1020252-68-9.webp)
(Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile
TL;DR: (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile (CAS 1020252-68-9) is a chemical compound with molecular formula C17H16BrN3OS and molecular weight 389.02 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]amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
Also Known As: (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile, (2Z)-2-({[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}methylidene)-4,4-dimethyl-3-oxopentanenitrile, 2-(2,2-DIMETHYLPROPANOYL)-3-((4-(4-BROMOPHENYL)(2,5-THIAZOLYL))AMINO)PROP-2-ENENITRILE, 2-[[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]methylidene]-4,4-dimethyl-3-oxo-pentanenitrile, 2-[[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile
| Molecular Formula | C17H16BrN3OS |
|---|---|
| Molecular Weight | 389.02 g/mol |
| LogP | 5.00718 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.01974 |
| Heavy Atoms | 23 |
| Complexity | 779.4052 |
Chemical Identifiers
| CAS Number | 1020252-68-9 |
|---|---|
| SMILES | CC(C)(C)C(=O)C(=CNC1=NC(=CS1)C2=CC=C(C=C2)Br)C#N |
Product Overview
(Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile (CAS 1020252-68-9), with molecular formula C17H16BrN3OS and molecular weight 389.02 g/mol. IUPAC: 2-[[[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino]methylidene]-4,4-dimethyl-3-oxopentanenitrile.
Chemical Property Profile of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile
Property Insights of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile
The XLogP value of 5.00718 indicates that (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile. Following Lipinski's Rule of Five, (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile?
The CAS number of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile is 1020252-68-9.
What is the molecular formula of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile?
The molecular formula of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile is C17H16BrN3OS.
What is the molecular weight of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile?
The molecular weight of (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile is 389.02 g/mol.
Where can I buy (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile?
You can request a quote for (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-{[4-(4-bromophenyl)-1,3-thiazol-2-yl]amino}-2-(2,2-dimethylpropanoyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.