5,5'-carbonylbis[2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-isoindole-1,3(2H)-dione]
Chemical Structure Depiction of
5,5'-carbonylbis[2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-isoindole-1,3(2H)-dione]
5,5'-carbonylbis[2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-isoindole-1,3(2H)-dione]
Compound characteristics
| Compound ID: | 8003-0954 |
| Compound Name: | 5,5'-carbonylbis[2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-1H-isoindole-1,3(2H)-dione] |
| Molecular Weight: | 692.69 |
| Molecular Formula: | C39 H28 N6 O7 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)N1C(c2ccc(cc2C1=O)C(c1ccc2C(N(C3=C(C)N(C)N(C3=O)c3ccccc3)C(c2c1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4194 |
| logD: | 3.4194 |
| logSw: | -3.8119 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 111.189 |
| InChI Key: | BCUNJZMKLWFZKT-UHFFFAOYSA-N |