2-[(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)carbamoyl]phenyl acetate
Chemical Structure Depiction of
2-[(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)carbamoyl]phenyl acetate
2-[(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)carbamoyl]phenyl acetate
Compound characteristics
| Compound ID: | D097-0006 |
| Compound Name: | 2-[(3-benzoyl-2-methyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl)carbamoyl]phenyl acetate |
| Molecular Weight: | 476.51 |
| Molecular Formula: | C25 H20 N2 O6 S |
| Smiles: | CC(=O)Oc1ccccc1C(NC1=C(C(c2ccccc2)=O)N(C)S(c2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7322 |
| logD: | -1.7083 |
| logSw: | -4.1969 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.544 |
| InChI Key: | VGJLOXOQIMIMCU-UHFFFAOYSA-N |