1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-(2,3,4-trimethoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-(2,3,4-trimethoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-(2,3,4-trimethoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | K257-0046 |
| Compound Name: | 1-(3-bromobenzoyl)-5-(2,4-dichlorophenyl)-3-(2,3,4-trimethoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 635.3 |
| Molecular Formula: | C27 H22 Br Cl2 N3 O6 |
| Smiles: | COc1ccc(C2C3C(C(N(C3=O)c3ccc(cc3[Cl])[Cl])=O)N(C(c3cccc(c3)[Br])=O)N2)c(c1OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4629 |
| logD: | 4.4609 |
| logSw: | -4.6384 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.944 |
| InChI Key: | DSPFMEDEGSWMLD-UHFFFAOYSA-N |