N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2095 |
| Compound Name: | N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 461.93 |
| Molecular Formula: | C24 H16 Cl N3 O3 S |
| Smiles: | Cc1ccc2c(c1)oc(c1cc(ccc1[Cl])NC(NC(c1cc3ccccc3o1)=O)=S)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.9151 |
| logD: | 6.9149 |
| logSw: | -6.59 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.343 |
| InChI Key: | PKISQQHRQMMORQ-UHFFFAOYSA-N |