N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-0489 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-(4-fluorophenyl)-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 403.39 |
| Molecular Formula: | C18 H14 F N3 O5 S |
| Smiles: | CN1C(=CC(c2ccc(cc2)F)=NS1(=O)=O)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7051 |
| logD: | 2.0208 |
| logSw: | -3.3691 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.434 |
| InChI Key: | NBBDYUPEPUMBAV-UHFFFAOYSA-N |