2-{6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-{6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}-N-[3-(methylsulfanyl)phenyl]acetamide
2-{6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | E871-0128 |
| Compound Name: | 2-{6-[(4-fluorophenyl)methyl]-1,1-dioxo-1lambda~6~,2,6-thiadiazinan-2-yl}-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 423.53 |
| Molecular Formula: | C19 H22 F N3 O3 S2 |
| Smiles: | CSc1cccc(c1)NC(CN1CCCN(Cc2ccc(cc2)F)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9287 |
| logD: | 2.9287 |
| logSw: | -3.3876 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.528 |
| InChI Key: | JSCQJUYJSYENOT-UHFFFAOYSA-N |