4-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
Chemical Structure Depiction of
4-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
4-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3-nitro-N-[2-(trifluoromethyl)phenyl]benzamide
Compound characteristics
| Compound ID: | K781-3175 |
| Compound Name: | 4-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3-nitro-N-[2-(trifluoromethyl)phenyl]benzamide |
| Molecular Weight: | 469.44 |
| Molecular Formula: | C20 H18 F3 N3 O5 S |
| Smiles: | C1COCCN1C(CSc1ccc(cc1[N+]([O-])=O)C(Nc1ccccc1C(F)(F)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.258 |
| logD: | 3.2568 |
| logSw: | -3.8376 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.742 |
| InChI Key: | NWCTUICLHWHYQZ-UHFFFAOYSA-N |