(Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile
TL;DR: (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile (CAS 1164503-74-5) is a chemical compound with molecular formula C13H10N2S and molecular weight 226.05647 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile
Also Known As: 3-anilino-2-(3-thienyl)acrylonitrile, (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile
Technical Specifications
| Molecular Formula | C13H10N2S |
| Molecular Weight | 226.05647 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 64.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.05647 Da |
| Heavy Atoms | 16 |
| Complexity | 296.0 |
| SMILES | C1=CC=C(C=C1)N/C=C(\C#N)/C2=CSC=C2 |
| InChIKey | ILFIYBBQXVIHCB-FMIVXFBMSA-N |
Chemical Property Profile of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile
Property Insights of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile
The XLogP value of 3.6 indicates that (Z)-3-anilino-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-anilino-2-thiophen-3-ylprop-2-enenitrile. Following Lipinski's Rule of Five, (Z)-3-anilino-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-anilino-2-thiophen-3-ylprop-2-enenitrile?
The CAS number of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile is 1164503-74-5.
What is the molecular formula of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile?
The molecular formula of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile is C13H10N2S.
What is the molecular weight of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile?
The molecular weight of (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile is 226.05647 g/mol.
Where can I buy (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile?
You can request a quote for (Z)-3-anilino-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-anilino-2-thiophen-3-ylprop-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for (Z)-3-anilino-2-thiophen-3-ylprop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.