N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-8-ethoxy-2-imino-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-8-ethoxy-2-imino-2H-1-benzopyran-3-carboxamide
N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-8-ethoxy-2-imino-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | Y200-6601 |
| Compound Name: | N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-8-ethoxy-2-imino-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C20 H19 N3 O3 S |
| Smiles: | CCc1c(C#N)c(NC(C2=Cc3cccc(c3OC2=N)OCC)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 3.8341 |
| logD: | 0.6196 |
| logSw: | -4.3417 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.313 |
| InChI Key: | DODSQZDNIQCXQF-UHFFFAOYSA-N |