methyl 4-[5-(4-chlorophenyl)-3-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate
Chemical Structure Depiction of
methyl 4-[5-(4-chlorophenyl)-3-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate
methyl 4-[5-(4-chlorophenyl)-3-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate
Compound characteristics
| Compound ID: | C390-0050 |
| Compound Name: | methyl 4-[5-(4-chlorophenyl)-3-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyrrolo[3,4-c]pyrazol-4-yl]benzoate |
| Molecular Weight: | 457.92 |
| Molecular Formula: | C26 H20 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1)c1c2C(c3ccc(cc3)C(=O)OC)N(C(c2[nH]n1)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7964 |
| logD: | 5.7964 |
| logSw: | -6.3052 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.701 |
| InChI Key: | SDYJDNQXYPOMMZ-XMMPIXPASA-N |