methyl 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Chemical Structure Depiction of
methyl 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
methyl 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate
Compound characteristics
| Compound ID: | S342-0952 |
| Compound Name: | methyl 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-5-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2,6-thiadiazine-4-carboxylate |
| Molecular Weight: | 424.45 |
| Molecular Formula: | C18 H21 F N4 O5 S |
| Smiles: | CC1C(=CN(CC(N2CCN(CC2)c2ccccc2F)=O)S(N=1)(=O)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.4394 |
| logD: | 0.4394 |
| logSw: | -2.0553 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.024 |
| InChI Key: | LCQCTABLROTFAT-UHFFFAOYSA-N |