N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide
N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2066 |
| Compound Name: | N-({4-[(pyridin-4-yl)methyl]phenyl}carbamothioyl)-1-benzofuran-2-carboxamide |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C22 H17 N3 O2 S |
| Smiles: | C(c1ccc(cc1)NC(NC(c1cc2ccccc2o1)=O)=S)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 4.6742 |
| logD: | 4.6739 |
| logSw: | -5.158 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.689 |
| InChI Key: | JSBYBQQJBODFAV-UHFFFAOYSA-N |