methyl 4-(4-cyanophenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-(4-cyanophenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 4-(4-cyanophenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | G917-0269 |
| Compound Name: | methyl 4-(4-cyanophenyl)-6-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 358.35 |
| Molecular Formula: | C17 H11 F N2 O4 S |
| Smiles: | COC(C1=CN(c2ccc(C#N)cc2)c2cc(ccc2S1(=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8922 |
| logD: | 1.8922 |
| logSw: | -2.549 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.18 |
| InChI Key: | LMSGIDFZJGCRCY-UHFFFAOYSA-N |