2-(3,4-dimethoxybenzoyl)-4-(3,5-dimethoxyphenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
2-(3,4-dimethoxybenzoyl)-4-(3,5-dimethoxyphenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
2-(3,4-dimethoxybenzoyl)-4-(3,5-dimethoxyphenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | F390-0594 |
| Compound Name: | 2-(3,4-dimethoxybenzoyl)-4-(3,5-dimethoxyphenyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 499.51 |
| Molecular Formula: | C25 H22 F N O7 S |
| Smiles: | COc1cc(cc(c1)OC)N1C=C(C(c2ccc(c(c2)OC)OC)=O)S(c2ccc(cc12)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8551 |
| logD: | 3.8551 |
| logSw: | -4.1572 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.766 |
| InChI Key: | INLJLWLLFNPFQK-UHFFFAOYSA-N |