N~4~,N~5~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-1H-pyrazole-4,5-dicarboxamide
Chemical Structure Depiction of
N~4~,N~5~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-1H-pyrazole-4,5-dicarboxamide
N~4~,N~5~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-1H-pyrazole-4,5-dicarboxamide
Compound characteristics
| Compound ID: | Y504-8379 |
| Compound Name: | N~4~,N~5~-bis(2,3-dihydro-1,4-benzodioxin-6-yl)-1-methyl-1H-pyrazole-4,5-dicarboxamide |
| Molecular Weight: | 436.42 |
| Molecular Formula: | C22 H20 N4 O6 |
| Smiles: | Cn1c(C(Nc2ccc3c(c2)OCCO3)=O)c(cn1)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6626 |
| logD: | 0.6507 |
| logSw: | -2.2649 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.583 |
| InChI Key: | YQDOHGLAUNEHMB-UHFFFAOYSA-N |