2-chloro-N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Chemical Structure Depiction of
2-chloro-N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
2-chloro-N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Compound characteristics
| Compound ID: | IB08-7172 |
| Compound Name: | 2-chloro-N-{[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide |
| Molecular Weight: | 456.35 |
| Molecular Formula: | C22 H15 Cl2 N3 O2 S |
| Smiles: | Cc1ccc2c(c1)oc(c1cc(ccc1[Cl])NC(NC(c1ccccc1[Cl])=O)=S)n2 |
| Stereo: | ACHIRAL |
| logP: | 6.41 |
| logD: | 6.41 |
| logSw: | -7.2 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 128.13 |
| InChI Key: | DRPMPNODBPHTCS-UHFFFAOYSA-N |