N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2316 |
| Compound Name: | N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 427.95 |
| Molecular Formula: | C22 H22 Cl N3 O2 S |
| Smiles: | Cc1c2ccccc2oc1C(NC(Nc1ccc(c(c1)[Cl])N1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3833 |
| logD: | 6.3726 |
| logSw: | -6.1427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.917 |
| InChI Key: | YQGKFLXGKMXWMD-UHFFFAOYSA-N |