2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8013-0857 |
| Compound Name: | 2-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione |
| Molecular Weight: | 351.36 |
| Molecular Formula: | C19 H17 N3 O4 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)N1C(C2C(C3C=CC2O3)C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.0402 |
| logD: | 0.0402 |
| logSw: | -0.6219 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.604 |
| InChI Key: | YNNUVFDHJLOEGF-UHFFFAOYSA-N |