N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2042 |
| Compound Name: | N-{[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 477.92 |
| Molecular Formula: | C24 H16 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1[Cl])c1nc2cc(ccc2o1)NC(NC(c1cc2ccccc2o1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.1243 |
| logD: | 6.1239 |
| logSw: | -6.3719 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.973 |
| InChI Key: | YVKGBZFKRWSWND-UHFFFAOYSA-N |