3-methyl-N-{[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-{[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
3-methyl-N-{[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2282 |
| Compound Name: | 3-methyl-N-{[2-(2-methylphenyl)-1,3-benzoxazol-5-yl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 441.51 |
| Molecular Formula: | C25 H19 N3 O3 S |
| Smiles: | Cc1ccccc1c1nc2cc(ccc2o1)NC(NC(c1c(C)c2ccccc2o1)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.3573 |
| logD: | 6.3559 |
| logSw: | -5.7171 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.576 |
| InChI Key: | AJDBFNWOJPAWKX-UHFFFAOYSA-N |