methyl 4-(3-fluorophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Chemical Structure Depiction of
methyl 4-(3-fluorophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
methyl 4-(3-fluorophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate
Compound characteristics
| Compound ID: | G917-0045 |
| Compound Name: | methyl 4-(3-fluorophenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,4-benzothiazine-2-carboxylate |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C16 H12 F N O4 S |
| Smiles: | COC(C1=CN(c2cccc(c2)F)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0609 |
| logD: | 2.0609 |
| logSw: | -2.5611 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.124 |
| InChI Key: | QPLJQVZFUCAPRY-UHFFFAOYSA-N |