N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-(4-bromo-5-methyl-1H-pyrazol-1-yl)propanamide
Chemical Structure Depiction of
N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-(4-bromo-5-methyl-1H-pyrazol-1-yl)propanamide
N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-(4-bromo-5-methyl-1H-pyrazol-1-yl)propanamide
Compound characteristics
| Compound ID: | Y502-5366 |
| Compound Name: | N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-2-(4-bromo-5-methyl-1H-pyrazol-1-yl)propanamide |
| Molecular Weight: | 394.22 |
| Molecular Formula: | C16 H16 Br N3 O4 |
| Smiles: | CC(C(Nc1cc2c(cc1C(C)=O)OCO2)=O)n1c(C)c(cn1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0788 |
| logD: | 1.9284 |
| logSw: | -2.7995 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.863 |
| InChI Key: | SXAMUAGUWHPLJF-VIFPVBQESA-N |