4-[(2,5-dimethylphenyl)methyl]-2-[(4-fluorophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Chemical Structure Depiction of
4-[(2,5-dimethylphenyl)methyl]-2-[(4-fluorophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
4-[(2,5-dimethylphenyl)methyl]-2-[(4-fluorophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione
Compound characteristics
| Compound ID: | K261-1580 |
| Compound Name: | 4-[(2,5-dimethylphenyl)methyl]-2-[(4-fluorophenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C23 H21 F N2 O3 S |
| Smiles: | Cc1ccc(C)c(CN2C(N(Cc3ccc(cc3)F)S(c3ccccc23)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.2488 |
| logD: | 5.2488 |
| logSw: | -4.9886 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.959 |
| InChI Key: | INKRKXGBDZTXQS-UHFFFAOYSA-N |