1-benzyl-3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Chemical Structure Depiction of
1-benzyl-3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
1-benzyl-3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid
Compound characteristics
| Compound ID: | C229-1020 |
| Compound Name: | 1-benzyl-3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylic acid |
| Molecular Weight: | 504.51 |
| Molecular Formula: | C28 H25 F N2 O6 |
| Smiles: | COc1ccc(cc1OC)C1C2C(C(N(C2=O)c2ccc(cc2)F)=O)C(Cc2ccccc2)(C(O)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5978 |
| logD: | 0.3069 |
| logSw: | -2.9765 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.821 |
| InChI Key: | NBBGGRUKOQSQIY-UHFFFAOYSA-N |