4-[(2,5-dimethylphenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-[(2,5-dimethylphenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-[(2,5-dimethylphenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | K261-0992 |
| Compound Name: | 4-[(2,5-dimethylphenyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
| Molecular Weight: | 300.38 |
| Molecular Formula: | C16 H16 N2 O2 S |
| Smiles: | Cc1ccc(C)c(CN2C=NS(c3ccccc23)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.5601 |
| logD: | 3.5601 |
| logSw: | -3.7689 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.465 |
| InChI Key: | JEKCGGBPPHMEAK-UHFFFAOYSA-N |