1-(3-bromobenzoyl)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Chemical Structure Depiction of
1-(3-bromobenzoyl)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
1-(3-bromobenzoyl)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Compound characteristics
| Compound ID: | K257-0055 |
| Compound Name: | 1-(3-bromobenzoyl)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione |
| Molecular Weight: | 536.38 |
| Molecular Formula: | C26 H22 Br N3 O5 |
| Smiles: | COc1ccc(cc1)C1C2C(C(N(C2=O)c2ccccc2OC)=O)N(C(c2cccc(c2)[Br])=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1949 |
| logD: | 3.1937 |
| logSw: | -3.7083 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.054 |
| InChI Key: | PMCUTHWPEIWBKJ-UHFFFAOYSA-N |