N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide
Compound characteristics
| Compound ID: | D356-2692 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(9-fluoro-5,5-dioxo-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl)acetamide |
| Molecular Weight: | 440.45 |
| Molecular Formula: | C22 H17 F N2 O5 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1c2ccc(cc2c2ccccc2S1(=O)=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.458 |
| logD: | 3.458 |
| logSw: | -3.9485 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.349 |
| InChI Key: | YCXQRZDWGDZOBS-UHFFFAOYSA-N |