3-(3-methoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
3-(3-methoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
3-(3-methoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | C171-0447 |
| Compound Name: | 3-(3-methoxyphenyl)-1-(4-methylbenzoyl)-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C27 H25 N3 O4 |
| Smiles: | Cc1ccc(cc1)C(N1C2C(C(c3cccc(c3)OC)N1)C(N(C2=O)c1ccc(C)cc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4249 |
| logD: | 3.4244 |
| logSw: | -3.7647 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.724 |
| InChI Key: | SAUGVEKUZHIRGY-UHFFFAOYSA-N |