5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-[4-(propan-2-yl)phenyl]-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-[4-(propan-2-yl)phenyl]-1,3-diazinane-2,4,6-trione
5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-[4-(propan-2-yl)phenyl]-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 8013-3512 |
| Compound Name: | 5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-1-[4-(propan-2-yl)phenyl]-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C25 H25 N5 O4 |
| Smiles: | CC(C)c1ccc(cc1)N1C(C(=C/NC2=C(C)N(C)N(C2=O)c2ccccc2)\C(NC1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0058 |
| logD: | 0.0551 |
| logSw: | -2.3267 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.373 |
| InChI Key: | AFRIBMYPQGFHGI-UHFFFAOYSA-N |