N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)-4-methylpiperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)-4-methylpiperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)-4-methylpiperidine-4-carboxamide
Compound characteristics
| Compound ID: | F710-0369 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2,1,3-benzothiadiazole-4-sulfonyl)-4-methylpiperidine-4-carboxamide |
| Molecular Weight: | 474.56 |
| Molecular Formula: | C21 H22 N4 O5 S2 |
| Smiles: | CC1(CCN(CC1)S(c1cccc2c1nsn2)(=O)=O)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0609 |
| logD: | 3.0609 |
| logSw: | -3.3975 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.431 |
| InChI Key: | GQVZESLBMKSXIT-UHFFFAOYSA-N |