4-({3-chloro-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione
Chemical Structure Depiction of
4-({3-chloro-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione
4-({3-chloro-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 4399-0313 |
| Compound Name: | 4-({3-chloro-5-methoxy-4-[(2-methylphenyl)methoxy]phenyl}methylidene)-1-phenylpyrazolidine-3,5-dione |
| Molecular Weight: | 448.91 |
| Molecular Formula: | C25 H21 Cl N2 O4 |
| Smiles: | Cc1ccccc1COc1c(cc(\C=C2/C(NN(C2=O)c2ccccc2)=O)cc1[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.1167 |
| logD: | 5.0539 |
| logSw: | -5.685 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.791 |
| InChI Key: | MARBATGQZTXFPV-UHFFFAOYSA-N |