2-(1H-benzimidazol-2-yl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
2-(1H-benzimidazol-2-yl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y021-3466 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 214.22 |
| Molecular Formula: | C11 H10 N4 O |
| Smiles: | CC1CC(N(c2nc3ccccc3[nH]2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1197 |
| logD: | 0.5775 |
| logSw: | -1.8437 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.157 |
| InChI Key: | VXBWIFKSEMEWIV-UHFFFAOYSA-N |