3-methyl-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
3-methyl-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2313 |
| Compound Name: | 3-methyl-N-{[4-(piperidin-1-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C22 H23 N3 O2 S |
| Smiles: | Cc1c2ccccc2oc1C(NC(Nc1ccc(cc1)N1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4827 |
| logD: | 5.4646 |
| logSw: | -5.5017 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.218 |
| InChI Key: | GZJXYIWXUSKIAT-UHFFFAOYSA-N |