5-methyl-2-(4-methylphenyl)-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
5-methyl-2-(4-methylphenyl)-1,2-dihydro-3H-pyrazol-3-one
5-methyl-2-(4-methylphenyl)-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y509-0864 |
| Compound Name: | 5-methyl-2-(4-methylphenyl)-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 188.23 |
| Molecular Formula: | C11 H12 N2 O |
| Smiles: | CC1=CC(N(c2ccc(C)cc2)N1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.982 |
| logD: | 1.379 |
| logSw: | -2.405 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.37 |
| InChI Key: | YAVQZXBVUORYNQ-UHFFFAOYSA-N |