(1H-benzotriazol-1-yl)(4-bromo-1-methyl-1H-pyrazol-3-yl)methanone
Chemical Structure Depiction of
(1H-benzotriazol-1-yl)(4-bromo-1-methyl-1H-pyrazol-3-yl)methanone
(1H-benzotriazol-1-yl)(4-bromo-1-methyl-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y500-0622 |
| Compound Name: | (1H-benzotriazol-1-yl)(4-bromo-1-methyl-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 306.12 |
| Molecular Formula: | C11 H8 Br N5 O |
| Smiles: | Cn1cc(c(C(n2c3ccccc3nn2)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.0446 |
| logD: | 1.0446 |
| logSw: | -1.6467 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.352 |
| InChI Key: | UPVUUEZCZAEXTB-UHFFFAOYSA-N |