5-[(2-bromophenoxy)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(2-bromophenoxy)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]furan-2-carboxamide
5-[(2-bromophenoxy)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y500-4350 |
| Compound Name: | 5-[(2-bromophenoxy)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]furan-2-carboxamide |
| Molecular Weight: | 449.26 |
| Molecular Formula: | C18 H17 Br N4 O5 |
| Smiles: | Cc1cc(nn1CCNC(c1ccc(COc2ccccc2[Br])o1)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.5666 |
| logD: | 2.5666 |
| logSw: | -2.83 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.673 |
| InChI Key: | XPBQUAXYSMMTAE-UHFFFAOYSA-N |