N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | D492-0038 |
| Compound Name: | N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 341.39 |
| Molecular Formula: | C17 H15 N3 O3 S |
| Smiles: | [H]N(C(C1COc2ccccc2O1)=O)c1ccnn1Cc1cccs1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6669 |
| logD: | 2.6668 |
| logSw: | -3.1339 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.218 |
| InChI Key: | AMJMGVKDTRKVBE-HNNXBMFYSA-N |