2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile
TL;DR: 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile (CAS 1164498-34-3) is a chemical compound with molecular formula C15H11N3O2S and molecular weight 297.0572 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(4-nitrophenyl)prop-2-enenitrile
Also Known As: BAS 00865355, AB00080695-01, 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile, (2E)-2-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(4-nitrophenyl)prop-2-enenitrile, (E)-2-(4-cyclopropylthiazol-2-yl)-3-(4-nitrophenyl)acrylonitrile
Technical Specifications
| Molecular Formula | C15H11N3O2S |
| Molecular Weight | 297.0572 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.0572 Da |
| Heavy Atoms | 21 |
| Complexity | 481.0 |
| SMILES | C1CC1C2=CSC(=N2)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/C#N |
| InChIKey | PZDYZOBOEJSNRW-KPKJPENVSA-N |
Chemical Property Profile of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile
Property Insights of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile
The XLogP value of 3.2 indicates that 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile. Following Lipinski's Rule of Five, 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile?
The CAS number of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile is 1164498-34-3.
What is the molecular formula of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile?
The molecular formula of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile is C15H11N3O2S.
What is the molecular weight of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile?
The molecular weight of 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile is 297.0572 g/mol.
Where can I buy 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile?
You can request a quote for 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile?
Yes, CoreyChem provides custom synthesis services for 2-(4-Cyclopropyl-thiazol-2-yl)-3-(4-nitro-phenyl)-acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.