(2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile
TL;DR: (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile (CAS 315246-62-9) is a chemical compound with molecular formula C16H9BrN2S2 and molecular weight 371.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enenitrile
Also Known As: BAS 00866585, 2-[4-(3-Bromo-phenyl)-thiazol-2-yl]-3-thiophen-2-yl-acrylonitrile, (E)-2-(4-(3-bromophenyl)thiazol-2-yl)-3-(thiophen-2-yl)acrylonitrile, (2E)-2-[4-(3-bromophenyl)(1,3-thiazol-2-yl)]-3-(2-thienyl)prop-2-enenitrile, (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile
| Molecular Formula | C16H9BrN2S2 |
|---|---|
| Molecular Weight | 371.94 g/mol |
| LogP | 5.69828 |
| Topological Polar Surface Area | 36.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.93906 |
| Heavy Atoms | 21 |
| Complexity | 826.0915 |
Chemical Identifiers
| CAS Number | 315246-62-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Br)C2=CSC(=N2)/C(=C/C3=CC=CS3)/C#N |
Product Overview
(2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile (CAS 315246-62-9), with molecular formula C16H9BrN2S2 and molecular weight 371.94 g/mol. IUPAC: (E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylprop-2-enenitrile.
Chemical Property Profile of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile
Property Insights of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile
The XLogP value of 5.69828 indicates that (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.68 Ų, (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile?
The CAS number of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile is 315246-62-9.
What is the molecular formula of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile?
The molecular formula of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile is C16H9BrN2S2.
What is the molecular weight of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile?
The molecular weight of (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile is 371.94 g/mol.
Where can I buy (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile?
You can request a quote for (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-thienyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.