2-(3,4-dimethoxybenzoyl)-4-[4-(dimethylamino)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
2-(3,4-dimethoxybenzoyl)-4-[4-(dimethylamino)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
2-(3,4-dimethoxybenzoyl)-4-[4-(dimethylamino)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | F390-0556 |
| Compound Name: | 2-(3,4-dimethoxybenzoyl)-4-[4-(dimethylamino)phenyl]-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 464.54 |
| Molecular Formula: | C25 H24 N2 O5 S |
| Smiles: | CN(C)c1ccc(cc1)N1C=C(C(c2ccc(c(c2)OC)OC)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2389 |
| logD: | 3.2382 |
| logSw: | -3.8192 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.483 |
| InChI Key: | OWHTVEKQYDWOCR-UHFFFAOYSA-N |