1-(3-bromobenzoyl)-5-(2-chlorophenyl)-3-(2-fluorophenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-5-(2-chlorophenyl)-3-(2-fluorophenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-5-(2-chlorophenyl)-3-(2-fluorophenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | C171-0306 |
| Compound Name: | 1-(3-bromobenzoyl)-5-(2-chlorophenyl)-3-(2-fluorophenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 528.76 |
| Molecular Formula: | C24 H16 Br Cl F N3 O3 |
| Smiles: | c1ccc(c(c1)C1C2C(C(N(C2=O)c2ccccc2[Cl])=O)N(C(c2cccc(c2)[Br])=O)N1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9471 |
| logD: | 3.9451 |
| logSw: | -4.4791 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.879 |
| InChI Key: | AXAXRNDBDQAWDN-UHFFFAOYSA-N |