1-(3-bromobenzoyl)-3-(2-methoxyphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-3-(2-methoxyphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-3-(2-methoxyphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | C171-0393 |
| Compound Name: | 1-(3-bromobenzoyl)-3-(2-methoxyphenyl)-5-(3-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 520.38 |
| Molecular Formula: | C26 H22 Br N3 O4 |
| Smiles: | Cc1cccc(c1)N1C(C2C(c3ccccc3OC)NN(C2C1=O)C(c1cccc(c1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9526 |
| logD: | 3.9514 |
| logSw: | -4.1431 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.811 |
| InChI Key: | ITSWRBZBAJNIMH-UHFFFAOYSA-N |