4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl acetate
4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | 3584-0060 |
| Compound Name: | 4-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 320.35 |
| Molecular Formula: | C19 H16 N2 O3 |
| Smiles: | CC1/C(=C\c2ccc(cc2)OC(C)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.945 |
| logD: | 2.945 |
| logSw: | -3.4393 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.338 |
| InChI Key: | BOFBRFGLVZDACG-UHFFFAOYSA-N |