N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y505-1063 |
| Compound Name: | N-{1-[(4-bromophenyl)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 398.22 |
| Molecular Formula: | C16 H12 Br N7 O |
| Smiles: | C(c1ccc(cc1)[Br])n1ccc(NC(c2nc3ncccn3n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.6812 |
| logD: | 1.6583 |
| logSw: | -2.2348 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.904 |
| InChI Key: | OMHXLZFPHKXNPH-UHFFFAOYSA-N |