4-amino-5-benzoyl-2-(2-ethoxyanilino)thiophene-3-carbonitrile
Chemical Structure Depiction of
4-amino-5-benzoyl-2-(2-ethoxyanilino)thiophene-3-carbonitrile
4-amino-5-benzoyl-2-(2-ethoxyanilino)thiophene-3-carbonitrile
Compound characteristics
| Compound ID: | K264-0004 |
| Compound Name: | 4-amino-5-benzoyl-2-(2-ethoxyanilino)thiophene-3-carbonitrile |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C20 H17 N3 O2 S |
| Smiles: | CCOc1ccccc1Nc1c(C#N)c(c(C(c2ccccc2)=O)s1)N |
| Stereo: | ACHIRAL |
| logP: | 4.5135 |
| logD: | 4.5135 |
| logSw: | -4.5393 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.367 |
| InChI Key: | RUHVHLRDMVNBIG-UHFFFAOYSA-N |