2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl thiocyanate
Chemical Structure Depiction of
2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl thiocyanate
2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl thiocyanate
Compound characteristics
| Compound ID: | 8755-0147 |
| Compound Name: | 2-benzamido-4,5,6,7-tetrahydro-1-benzothiophen-3-yl thiocyanate |
| Molecular Weight: | 314.43 |
| Molecular Formula: | C16 H14 N2 O S2 |
| Smiles: | C1CCc2c(C1)c(c(NC(c1ccccc1)=O)s2)SC#N |
| Stereo: | ACHIRAL |
| logP: | 3.833 |
| logD: | 2.9498 |
| logSw: | -4.1065 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.841 |
| InChI Key: | YAWCUSGSEQWZJW-UHFFFAOYSA-N |