2-[(2,4-dimethylphenyl)methyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Chemical Structure Depiction of
2-[(2,4-dimethylphenyl)methyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
2-[(2,4-dimethylphenyl)methyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione
Compound characteristics
| Compound ID: | 8004-9872 |
| Compound Name: | 2-[(2,4-dimethylphenyl)methyl]-1H-1lambda~6~,2-benzothiazole-1,1,3(2H)-trione |
| Molecular Weight: | 301.36 |
| Molecular Formula: | C16 H15 N O3 S |
| Smiles: | Cc1ccc(CN2C(c3ccccc3S2(=O)=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.9425 |
| logD: | 2.9425 |
| logSw: | -3.3798 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.184 |
| InChI Key: | BAVREMXJWMYCQA-UHFFFAOYSA-N |