2-(4-chlorophenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
2-(4-chlorophenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | Y507-2991 |
| Compound Name: | 2-(4-chlorophenyl)-5-methyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 208.64 |
| Molecular Formula: | C10 H9 Cl N2 O |
| Smiles: | CC1=CC(N(c2ccc(cc2)[Cl])N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1538 |
| logD: | 0.8152 |
| logSw: | -3.0234 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.3713 |
| InChI Key: | BNMJZURGOFYNQV-UHFFFAOYSA-N |