4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-2396 |
| Compound Name: | 4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 352.18 |
| Molecular Formula: | C14 H14 Br N3 O3 |
| Smiles: | Cc1c(c(C(Nc2ccc3c(c2)OCCO3)=O)nn1C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.3096 |
| logD: | 1.3084 |
| logSw: | -2.2278 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.186 |
| InChI Key: | QDGMHKWBJKNZNC-UHFFFAOYSA-N |