methyl 4-(3-bromophenyl)-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-(3-bromophenyl)-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 4-(3-bromophenyl)-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | G917-0271 |
| Compound Name: | methyl 4-(3-bromophenyl)-7-fluoro-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 412.23 |
| Molecular Formula: | C16 H11 Br F N O4 S |
| Smiles: | COC(C1=CN(c2cccc(c2)[Br])c2ccc(cc2S1(=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0436 |
| logD: | 3.0436 |
| logSw: | -3.4622 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.124 |
| InChI Key: | HSQCCTOZHVOQDB-UHFFFAOYSA-N |