4-(4-butylphenyl)-2-(3,4-dimethoxybenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-(4-butylphenyl)-2-(3,4-dimethoxybenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-(4-butylphenyl)-2-(3,4-dimethoxybenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | F390-0590 |
| Compound Name: | 4-(4-butylphenyl)-2-(3,4-dimethoxybenzoyl)-6-fluoro-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 495.57 |
| Molecular Formula: | C27 H26 F N O5 S |
| Smiles: | CCCCc1ccc(cc1)N1C=C(C(c2ccc(c(c2)OC)OC)=O)S(c2ccc(cc12)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3857 |
| logD: | 5.3857 |
| logSw: | -5.3864 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.678 |
| InChI Key: | CYNSNAYVQRMLOL-UHFFFAOYSA-N |