N-(2H-1,3-benzodioxol-5-yl)-2-[6-(pyrrolidin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[6-(pyrrolidin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-2-[6-(pyrrolidin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide
Compound characteristics
| Compound ID: | M520-0082 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[6-(pyrrolidin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C20 H18 N4 O3 S |
| Smiles: | C1CCN(C1)c1ccc(cn1)c1nc(cs1)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.376 |
| logD: | 4.3507 |
| logSw: | -4.2113 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.598 |
| InChI Key: | JULLVTZKHPXBDE-UHFFFAOYSA-N |