3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | D316-0068 |
| Compound Name: | 3-acetyl-2-butyl-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 379.47 |
| Molecular Formula: | C19 H25 N O5 S |
| Smiles: | CCCCN1C(=C(c2ccccc2S1(=O)=O)OC(C(C)(C)C)=O)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7184 |
| logD: | 3.7184 |
| logSw: | -3.9262 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.716 |
| InChI Key: | SOILKJYMOKAGSD-UHFFFAOYSA-N |