9-(2,5-dimethyl-3-oxo-1-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Chemical Structure Depiction of
9-(2,5-dimethyl-3-oxo-1-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(2,5-dimethyl-3-oxo-1-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Compound characteristics
| Compound ID: | 8009-3298 |
| Compound Name: | 9-(2,5-dimethyl-3-oxo-1-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione |
| Molecular Weight: | 460.57 |
| Molecular Formula: | C28 H32 N2 O4 |
| Smiles: | CC1=C(C2C3=C(CC(C)(C)CC3=O)OC3CC(C)(C)CC(C2=3)=O)C(N(C)N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.399 |
| logD: | 3.399 |
| logSw: | -3.8028 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.579 |
| InChI Key: | XZFBPADESNGJFE-UHFFFAOYSA-N |