methyl 4-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}benzoate
methyl 4-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | D289-0381 |
| Compound Name: | methyl 4-{2-[5,5-dioxo-9-(propan-2-yl)-5lambda~6~-dibenzo[c,e][1,2]thiazin-6(5H)-yl]acetamido}benzoate |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C25 H24 N2 O5 S |
| Smiles: | CC(C)c1ccc2c(c1)c1ccccc1S(N2CC(Nc1ccc(cc1)C(=O)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3169 |
| logD: | 5.3168 |
| logSw: | -5.3828 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.085 |
| InChI Key: | KLFKRLMSEVVKBC-UHFFFAOYSA-N |