1-(3-bromobenzoyl)-3-[4-(dimethylamino)phenyl]-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-3-[4-(dimethylamino)phenyl]-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-3-[4-(dimethylamino)phenyl]-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | C171-0499 |
| Compound Name: | 1-(3-bromobenzoyl)-3-[4-(dimethylamino)phenyl]-5-(4-methylphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 533.42 |
| Molecular Formula: | C27 H25 Br N4 O3 |
| Smiles: | Cc1ccc(cc1)N1C(C2C(c3ccc(cc3)N(C)C)NN(C2C1=O)C(c1cccc(c1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8666 |
| logD: | 3.8629 |
| logSw: | -3.9972 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.985 |
| InChI Key: | YJWXLCQNNLSQFQ-UHFFFAOYSA-N |