3-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
3-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | G550-0633 |
| Compound Name: | 3-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]-6-(trifluoromethyl)-3,4-dihydro-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 468.5 |
| Molecular Formula: | C21 H23 F3 N4 O3 S |
| Smiles: | Cc1ccc(c(C)c1)N1CCN(CC1)C(C1Nc2cc(ccc2S(N1)(=O)=O)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.395 |
| logD: | 3.3939 |
| logSw: | -3.8743 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.98 |
| InChI Key: | HBVBQJDIULULDM-IBGZPJMESA-N |