2-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 4-methoxybenzoate
Chemical Structure Depiction of
2-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 4-methoxybenzoate
2-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 3268-0286 |
| Compound Name: | 2-[(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 4-methoxybenzoate |
| Molecular Weight: | 412.44 |
| Molecular Formula: | C25 H20 N2 O4 |
| Smiles: | CC1/C(=C\c2ccccc2OC(c2ccc(cc2)OC)=O)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4572 |
| logD: | 4.4572 |
| logSw: | -4.5823 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.595 |
| InChI Key: | YSNRFCCFAXHGBJ-UHFFFAOYSA-N |