3-(4-benzylpiperazine-1-carbonyl)-5-(furan-2-yl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(4-benzylpiperazine-1-carbonyl)-5-(furan-2-yl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(4-benzylpiperazine-1-carbonyl)-5-(furan-2-yl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-1034 |
| Compound Name: | 3-(4-benzylpiperazine-1-carbonyl)-5-(furan-2-yl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C20 H22 N4 O4 S |
| Smiles: | CN1C(=CC(c2ccco2)=NS1(=O)=O)C(N1CCN(CC1)Cc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5373 |
| logD: | 1.5265 |
| logSw: | -2.1591 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 73.994 |
| InChI Key: | ODJDTELPMVOIFB-UHFFFAOYSA-N |