3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate
Chemical Structure Depiction of
3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate
3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate
Compound characteristics
| Compound ID: | 6405-0005 |
| Compound Name: | 3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl (4-methylphenoxy)acetate |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C25 H21 N O6 S |
| Smiles: | Cc1ccc(cc1)OCC(=O)OC1=C(C(c2ccccc2)=O)N(C)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.702 |
| logD: | 4.702 |
| logSw: | -4.5961 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.016 |
| InChI Key: | QDDQGVRJZCOPJW-UHFFFAOYSA-N |