1-(3-bromobenzoyl)-3-(4-ethylphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-3-(4-ethylphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-3-(4-ethylphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | K257-0086 |
| Compound Name: | 1-(3-bromobenzoyl)-3-(4-ethylphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 518.41 |
| Molecular Formula: | C27 H24 Br N3 O3 |
| Smiles: | CCc1ccc(cc1)C1C2C(C(N(C2=O)c2cccc(C)c2)=O)N(C(c2cccc(c2)[Br])=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7822 |
| logD: | 4.781 |
| logSw: | -4.6367 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.18 |
| InChI Key: | QSULRBWXLINHHW-UHFFFAOYSA-N |