N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-1801 |
| Compound Name: | N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 339.37 |
| Molecular Formula: | C17 H13 N3 O3 S |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(c1cc(c3ccco3)on1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.537 |
| logD: | 2.224 |
| logSw: | -4.0529 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.214 |
| InChI Key: | KSPMTNBRDICCJB-UHFFFAOYSA-N |