2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 4-methylbenzoate
Chemical Structure Depiction of
2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 4-methylbenzoate
2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 4-methylbenzoate
Compound characteristics
| Compound ID: | D316-0359 |
| Compound Name: | 2-benzyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 4-methylbenzoate |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C23 H19 N O4 S |
| Smiles: | Cc1ccc(cc1)C(=O)OC1=CN(Cc2ccccc2)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3353 |
| logD: | 4.3353 |
| logSw: | -4.4606 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.232 |
| InChI Key: | IKMNGLIHJZZXTD-UHFFFAOYSA-N |