1-benzyl-5-(2,4-dichlorophenyl)-3-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Chemical Structure Depiction of
1-benzyl-5-(2,4-dichlorophenyl)-3-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
1-benzyl-5-(2,4-dichlorophenyl)-3-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Compound characteristics
| Compound ID: | C229-0648 |
| Compound Name: | 1-benzyl-5-(2,4-dichlorophenyl)-3-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid |
| Molecular Weight: | 509.39 |
| Molecular Formula: | C27 H22 Cl2 N2 O4 |
| Smiles: | Cc1ccc(cc1)C1C2C(C(N(C2=O)c2ccc(cc2[Cl])[Cl])=O)C(Cc2ccccc2)(C(O)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5918 |
| logD: | 2.3009 |
| logSw: | -4.7036 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.259 |
| InChI Key: | NEDFVRJIQPMVIX-UHFFFAOYSA-N |