N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-1915 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C17 H13 N3 O2 S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(c1cc(c3cccs3)on1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.2749 |
| logD: | 2.9618 |
| logSw: | -4.4399 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.654 |
| InChI Key: | PZRZIVNNRZNRRY-UHFFFAOYSA-N |