3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}-1,2,4-oxadiazole-5-carboxamide
3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | 8017-6978 |
| Compound Name: | 3-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-{[4-(1H-pyrrol-1-yl)phenyl]methyl}-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 455.31 |
| Molecular Formula: | C20 H19 Br N6 O2 |
| Smiles: | Cc1c(c(C)n(Cc2nc(C(NCc3ccc(cc3)n3cccc3)=O)on2)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.7652 |
| logD: | 2.7652 |
| logSw: | -3.0532 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.859 |
| InChI Key: | SVKPXSOCUFVLJH-UHFFFAOYSA-N |