dimethyl 2-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzene-1,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzene-1,4-dicarboxylate
dimethyl 2-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzene-1,4-dicarboxylate
Compound characteristics
| Compound ID: | D356-2702 |
| Compound Name: | dimethyl 2-[2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamido]benzene-1,4-dicarboxylate |
| Molecular Weight: | 498.49 |
| Molecular Formula: | C24 H19 F N2 O7 S |
| Smiles: | COC(c1ccc(C(=O)OC)c(c1)NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7819 |
| logD: | 3.7352 |
| logSw: | -4.0431 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.561 |
| InChI Key: | UBCKUWLCBCDXHU-UHFFFAOYSA-N |