(Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile
TL;DR: (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile (CAS 1164478-97-0) is a chemical compound with molecular formula C14H12N2S and molecular weight 240.07211 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile
Also Known As: 2-(3-thienyl)-3-(4-toluidino)acrylonitrile, (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile
Technical Specifications
| Molecular Formula | C14H12N2S |
| Molecular Weight | 240.07211 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.07211 Da |
| Heavy Atoms | 17 |
| Complexity | 320.0 |
| SMILES | CC1=CC=C(C=C1)N/C=C(\C#N)/C2=CSC=C2 |
| InChIKey | MUMLJJBCDLNKTP-UKTHLTGXSA-N |
Chemical Property Profile of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile
Property Insights of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile
The XLogP value of 4.0 indicates that (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile. Following Lipinski's Rule of Five, (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile?
The CAS number of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile is 1164478-97-0.
What is the molecular formula of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile?
The molecular formula of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile is C14H12N2S.
What is the molecular weight of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile?
The molecular weight of (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile is 240.07211 g/mol.
Where can I buy (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile?
You can request a quote for (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for (Z)-3-(4-methylanilino)-2-thiophen-3-ylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.