1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]piperidine-3-carboxamide
1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | C444-0227 |
| Compound Name: | 1-(2,1,3-benzothiadiazole-4-sulfonyl)-N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]piperidine-3-carboxamide |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C21 H22 N4 O5 S2 |
| Smiles: | C1CC(CN(C1)S(c1cccc2c1nsn2)(=O)=O)C(NCC1COc2ccccc2O1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4594 |
| logD: | 2.4594 |
| logSw: | -2.6476 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.928 |
| InChI Key: | VUUNOJLTZTZKLG-UHFFFAOYSA-N |