N-{1-[(1,3-benzoxazol-2-yl)sulfanyl]-2,2,2-trichloroethyl}benzamide
Chemical Structure Depiction of
N-{1-[(1,3-benzoxazol-2-yl)sulfanyl]-2,2,2-trichloroethyl}benzamide
N-{1-[(1,3-benzoxazol-2-yl)sulfanyl]-2,2,2-trichloroethyl}benzamide
Compound characteristics
| Compound ID: | 0867-0040 |
| Compound Name: | N-{1-[(1,3-benzoxazol-2-yl)sulfanyl]-2,2,2-trichloroethyl}benzamide |
| Molecular Weight: | 401.7 |
| Molecular Formula: | C16 H11 Cl3 N2 O2 S |
| Smiles: | c1ccc(cc1)C(NC(C([Cl])([Cl])[Cl])Sc1nc2ccccc2o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1744 |
| logD: | 4.6528 |
| logSw: | -5.7233 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.22 |
| InChI Key: | GOYCNQLBXVQLDY-AWEZNQCLSA-N |