N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide
Compound characteristics
| Compound ID: | C883-0159 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carboxamide |
| Molecular Weight: | 386.41 |
| Molecular Formula: | C22 H18 N4 O3 |
| Smiles: | C1COc2cc(ccc2O1)NC(c1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4612 |
| logD: | 3.4612 |
| logSw: | -3.5883 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.009 |
| InChI Key: | VLVHXOCHNMTLON-UHFFFAOYSA-N |