2-(2-cyano-3-phenylprop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Chemical Structure Depiction of
2-(2-cyano-3-phenylprop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
2-(2-cyano-3-phenylprop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Compound characteristics
| Compound ID: | 8645-0042 |
| Compound Name: | 2-(2-cyano-3-phenylprop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
| Molecular Weight: | 351.43 |
| Molecular Formula: | C19 H17 N3 O2 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(C(=C/c1ccccc1)\C#N)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.5258 |
| logD: | -0.3124 |
| logSw: | -2.8784 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.16 |
| InChI Key: | KJTVGOIEVUTGIS-UHFFFAOYSA-N |