N-(2H-1,3-benzodioxol-5-yl)-2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamide
Compound characteristics
| Compound ID: | D289-0255 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamide |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C24 H22 N2 O5 S |
| Smiles: | CC(C)c1ccc2c(c1)c1ccccc1S(N2CC(Nc1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0593 |
| logD: | 5.0593 |
| logSw: | -4.5392 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.027 |
| InChI Key: | AVHKHDGBZHDJHG-UHFFFAOYSA-N |