4-(4-bromo-1H-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
Chemical Structure Depiction of
4-(4-bromo-1H-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
4-(4-bromo-1H-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
Compound characteristics
| Compound ID: | 8018-5661 |
| Compound Name: | 4-(4-bromo-1H-pyrazol-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide |
| Molecular Weight: | 400.23 |
| Molecular Formula: | C18 H14 Br N3 O3 |
| Smiles: | C1COc2cc(ccc2O1)NC(c1ccc(cc1)n1cc(cn1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6567 |
| logD: | 2.6546 |
| logSw: | -3.0785 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.51 |
| InChI Key: | ROGDGRGVNNWSJO-UHFFFAOYSA-N |