4-benzylidene-2-(2,5-dichlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-benzylidene-2-(2,5-dichlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
4-benzylidene-2-(2,5-dichlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2421-1155 |
| Compound Name: | 4-benzylidene-2-(2,5-dichlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 331.2 |
| Molecular Formula: | C17 H12 Cl2 N2 O |
| Smiles: | CC1/C(=C/c2ccccc2)C(N(c2cc(ccc2[Cl])[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6698 |
| logD: | 4.6698 |
| logSw: | -4.964 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.2859 |
| InChI Key: | SKPGUYASUQCPIY-UHFFFAOYSA-N |