N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazine-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | SC19-0564 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(1-ethyl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazol-3-yl)methyl]piperazine-1-carboxamide |
| Molecular Weight: | 427.5 |
| Molecular Formula: | C22 H29 N5 O4 |
| Smiles: | CCn1c2CCOCc2c(CN2CCN(CC2)C(Nc2ccc3c(c2)OCCO3)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.1681 |
| logD: | -3.8576 |
| logSw: | -2.1038 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.35 |
| InChI Key: | VBAUIRDDXIGLDE-UHFFFAOYSA-N |