3-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]-5-(3-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]-5-(3-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]-5-(3-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-0387 |
| Compound Name: | 3-[4-(2,2-dimethylpropanoyl)piperazine-1-carbonyl]-5-(3-methoxyphenyl)-2-methyl-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C21 H28 N4 O5 S |
| Smiles: | CC(C)(C)C(N1CCN(CC1)C(C1=CC(c2cccc(c2)OC)=NS(N1C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0045 |
| logD: | 2.0045 |
| logSw: | -2.5613 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 86.147 |
| InChI Key: | XDZYWAOQTZACNI-UHFFFAOYSA-N |