N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-ynamide
Chemical Structure Depiction of
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-ynamide
N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-ynamide
Compound characteristics
| Compound ID: | Y206-3332 |
| Compound Name: | N-(3-cyano-4,5-dimethylthiophen-2-yl)-3-phenylprop-2-ynamide |
| Molecular Weight: | 280.35 |
| Molecular Formula: | C16 H12 N2 O S |
| Smiles: | Cc1c(C#N)c(NC(C#Cc2ccccc2)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 4.1478 |
| logD: | 3.5228 |
| logSw: | -4.3209 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.967 |
| InChI Key: | XJLJOAWLZXPNQF-UHFFFAOYSA-N |