4-fluoro-N-{[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Chemical Structure Depiction of
4-fluoro-N-{[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
4-fluoro-N-{[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | 3820-6769 |
| Compound Name: | 4-fluoro-N-{[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]carbamothioyl}benzamide |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C20 H13 F N4 O2 S |
| Smiles: | c1cc(ccc1C(NC(Nc1ccc2c(c1)nc(c1ccncc1)o2)=S)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.7088 |
| logD: | 3.7019 |
| logSw: | -4.1448 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.478 |
| InChI Key: | XQYVILHYNHEYIW-UHFFFAOYSA-N |