N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-2-chlorobenzamide
N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | Y502-2566 |
| Compound Name: | N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-2-chlorobenzamide |
| Molecular Weight: | 356.65 |
| Molecular Formula: | C14 H15 Br Cl N3 O |
| Smiles: | Cc1c(cn(CCCNC(c2ccccc2[Cl])=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7173 |
| logD: | 2.7173 |
| logSw: | -3.6244 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.602 |
| InChI Key: | POBJKITYUQBSEV-UHFFFAOYSA-N |