3-methyl-N-[(pyridin-3-yl)carbamothioyl]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-[(pyridin-3-yl)carbamothioyl]-1-benzofuran-2-carboxamide
3-methyl-N-[(pyridin-3-yl)carbamothioyl]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2239 |
| Compound Name: | 3-methyl-N-[(pyridin-3-yl)carbamothioyl]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 311.36 |
| Molecular Formula: | C16 H13 N3 O2 S |
| Smiles: | Cc1c2ccccc2oc1C(NC(Nc1cccnc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5286 |
| logD: | 3.5252 |
| logSw: | -3.6122 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.284 |
| InChI Key: | DSMCLZSPMNGQKT-UHFFFAOYSA-N |