N-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-[(2-bromophenoxy)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-[(2-bromophenoxy)methyl]furan-2-carboxamide
N-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-[(2-bromophenoxy)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y500-4351 |
| Compound Name: | N-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-5-[(2-bromophenoxy)methyl]furan-2-carboxamide |
| Molecular Weight: | 497.18 |
| Molecular Formula: | C19 H19 Br2 N3 O3 |
| Smiles: | Cc1c(c(C)n(CCNC(c2ccc(COc3ccccc3[Br])o2)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.5709 |
| logD: | 3.5709 |
| logSw: | -3.6739 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.181 |
| InChI Key: | KXGGNFVXQLGUDR-UHFFFAOYSA-N |