4,4'-[(4-chloro-1,3-phenylene)bis(azanediylmethanylylidene)]bis[2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one]
Chemical Structure Depiction of
4,4'-[(4-chloro-1,3-phenylene)bis(azanediylmethanylylidene)]bis[2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one]
4,4'-[(4-chloro-1,3-phenylene)bis(azanediylmethanylylidene)]bis[2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one]
Compound characteristics
| Compound ID: | 8004-8664 |
| Compound Name: | 4,4'-[(4-chloro-1,3-phenylene)bis(azanediylmethanylylidene)]bis[2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one] |
| Molecular Weight: | 579.87 |
| Molecular Formula: | C28 H21 Cl3 N6 O2 |
| Smiles: | CC1\C(=C/Nc2ccc(c(c2)N/C=C2\C(C)=NN(C2=O)c2cccc(c2)[Cl])[Cl])C(N(c2cccc(c2)[Cl])N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0344 |
| logD: | 6.0335 |
| logSw: | -6.2346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.439 |
| InChI Key: | FDHULDKYQKRREM-UHFFFAOYSA-N |