4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-4-phenyl-1,3-thiazol-3(2H)-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-4-phenyl-1,3-thiazol-3(2H)-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-4-phenyl-1,3-thiazol-3(2H)-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 4052-1420 |
| Compound Name: | 4-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-4-phenyl-1,3-thiazol-3(2H)-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 548.67 |
| Molecular Formula: | C31 H28 N6 O2 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=C1/N(C(=CS1)c1ccccc1)C1=C(C)N(C)N(C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7222 |
| logD: | 3.7217 |
| logSw: | -3.9655 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.173 |
| InChI Key: | QUGKPIBWDKJHGY-UHFFFAOYSA-N |