2-(2,4-dimethylbenzoyl)-6-fluoro-4-(4-methylphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
2-(2,4-dimethylbenzoyl)-6-fluoro-4-(4-methylphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
2-(2,4-dimethylbenzoyl)-6-fluoro-4-(4-methylphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
Compound ID: | F390-0459 |
Compound Name: | 2-(2,4-dimethylbenzoyl)-6-fluoro-4-(4-methylphenyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
Molecular Weight: | 421.49 |
Molecular Formula: | C24 H20 F N O3 S |
Smiles: | Cc1ccc(cc1)N1C=C(C(c2ccc(C)cc2C)=O)S(c2ccc(cc12)F)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.0399 |
logD: | 5.0399 |
logSw: | -4.7099 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 44.417 |
InChI Key: | XPIPHVQXRYIYLP-UHFFFAOYSA-N |