2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-c]quinazoline
Chemical Structure Depiction of
2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-c]quinazoline
2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-c]quinazoline
Compound characteristics
| Compound ID: | Y502-8120 |
| Compound Name: | 2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}[1,2,4]triazolo[1,5-c]quinazoline |
| Molecular Weight: | 455.7 |
| Molecular Formula: | C19 H12 Br Cl N6 O |
| Smiles: | C(n1ccc(c2nc3c4ccccc4ncn3n2)n1)Oc1ccc(cc1[Br])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.3705 |
| logD: | 4.3695 |
| logSw: | -4.5891 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.18 |
| InChI Key: | FKIBPSMZAGVUFA-UHFFFAOYSA-N |