3-benzoyl-2-[2-(dimethylamino)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
3-benzoyl-2-[2-(dimethylamino)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
3-benzoyl-2-[2-(dimethylamino)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | D239-0033 |
| Compound Name: | 3-benzoyl-2-[2-(dimethylamino)ethyl]-1,1-dioxo-1,2-dihydro-1lambda~6~,2-benzothiazin-4-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C24 H28 N2 O5 S |
| Smiles: | CC(C)(C)C(=O)OC1=C(C(c2ccccc2)=O)N(CCN(C)C)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0027 |
| logD: | 3.8084 |
| logSw: | -4.2374 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.222 |
| InChI Key: | ZSZWVEQYQDBOKT-UHFFFAOYSA-N |