3-(4-benzylpiperazine-1-carbonyl)-5-(4-fluorophenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(4-benzylpiperazine-1-carbonyl)-5-(4-fluorophenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(4-benzylpiperazine-1-carbonyl)-5-(4-fluorophenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-0518 |
| Compound Name: | 3-(4-benzylpiperazine-1-carbonyl)-5-(4-fluorophenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 442.51 |
| Molecular Formula: | C22 H23 F N4 O3 S |
| Smiles: | CN1C(=CC(c2ccc(cc2)F)=NS1(=O)=O)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4849 |
| logD: | 2.4742 |
| logSw: | -2.5971 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.416 |
| InChI Key: | IQYMQCTWASPOGX-UHFFFAOYSA-N |